Activity	Pa-Pi (Parent compound)	Pa-Pi (Metabolite compound)
Antiinflammatory	0.992(CHEMBL1473;­CHEMBL1504;­DB00588;­DB00620;­DB00764;­DB01234;­DB08906;­DB11921;­METXBIODB00696) 0.991(DB06781) 0.990(CHEMBL1512;­DB14669)	0.994(DBMET02573) 0.992(CHEMBL3542337;­DB00443;­DBMET00450;­DBMET01644;­DBMET01645;­DBMET02361;­DBMET02591;­DBMET02758;­METXBIODB00697;­METXBIODB00698) 0.991(CHEMBL3542318;­DBMET00837 )
Ulceration	0.960(DB00605) 0.948(CHEMBL6;­DB00328;­METXBIODB00921) 0.936(DB13783)	0.948(DBMET01882) 0.941(DBMET01003) 0.929(CHEMBL800;­DBMET00156;­METXBIODB00922 )
CYP2C9 substrate	0.992(METXBIODB01048) 0.988(CHEMBL269732;­DB00864;­METXBIODB00828;­METXBIODB00831) 0.983(CHEMBL92;­DB01248;­METXBIODB01531)	0.990(METXBIODB01049) 0.989(CHEMBL3706531) 0.988(CHEMBL3544602;­CHEMBL3544709;­CHEMBL3544837;­METXBIODB00832 )
Analgesic	0.993(DB01294) 0.992(DB00921;­METXBIODB01912) 0.988(DB00704)	0.992(DBMET00174) 0.987(DBMET00424) 0.986(DBMET00321;­METXBIODB01140 )
Rheumatoid arthritis treatment	0.996(DB01294) 0.954(DB08877) 0.936(DB06670)	0.959(DBMET03261) 0.945(DBMET02573) 0.944(DBMET00219 )
Analgesic, non-opioid	0.989(DB00727) 0.958(DB00673) 0.941(DB01221;­DB11823;­METXBIODB00118)	0.989(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.969(DBMET01506) 0.943(DBMET01503 )
Antipyretic	0.958(DB04817) 0.907(DB01452) 0.899(METXBIODB00798)	0.930(METXBIODB02935) 0.928(METXBIODB03001) 0.924(DBMET00153;­METXBIODB03085 )
CYP2C19 substrate	0.992(METXBIODB01048) 0.986(METXBIODB01531) 0.983(DB00361)	0.990(METXBIODB01049) 0.983(DBMET02029) 0.982(METXBIODB01532 )
Cardiovascular analeptic	0.979(DB01744;­DB11345;­METXBIODB01913) 0.967(DB01102;­DB09081) 0.957(METXBIODB00781;­METXBIODB02214)	0.974(DBMET02830) 0.970(METXBIODB01914) 0.967(DBMET01521;­DBMET01522;­DBMET01523 )
UGT1A9 substrate	0.972(METXBIODB02133) 0.963(DB11638) 0.962(DB00783;­METXBIODB01814)	0.991(DBMET00581;­METXBIODB02222) 0.990(METXBIODB02134;­METXBIODB02135) 0.989(DBMET00571;­METXBIODB02217 )
Gout treatment	0.849(DB04854) 0.812(DB01138) 0.732(METXBIODB00230)	0.853(DBMET03281) 0.842(DBMET03279) 0.821(DBMET03280 )
GST A substrate	0.991(DB00929) 0.982(DB00770) 0.977(METXBIODB03135)	0.990(DBMET02637) 0.989(METXBIODB01072) 0.982(DBMET02086 )
CYP3A4 substrate	0.996(DB06287) 0.995(DB00778;­METXBIODB01048;­METXBIODB01286) 0.990(METXBIODB00817)	0.996(DBMET03414;­DBMET03415) 0.994(METXBIODB00819;­METXBIODB01287) 0.990(CHEMBL3544670;­DBMET01750;­METXBIODB01378 )
5 Hydroxytryptamine release inhibitor	0.970(DB12095) 0.842(CHEMBL25;­DB00945) 0.773(DB11994)	0.953(DBMET03552) 0.951(DBMET03555) 0.937(DBMET03554 )
UGT2B4 substrate	0.971(DB04630) 0.954(DB00741;­METXBIODB01729) 0.922(METXBIODB01980)	0.946(DBMET02900;­DBMET02901;­DBMET02902) 0.934(METXBIODB01981) 0.932(DB14681 )
5 Hydroxytryptamine release stimulant	0.948(DB04844) 0.944(METXBIODB00577) 0.943(METXBIODB01523)	0.941(METXBIODB00578) 0.930(METXBIODB01524) 0.908(DBMET01359 )
Antithrombotic	0.964(CHEMBL1783834;­DB01240) 0.935(DB00770) 0.878(DB11660)	0.970(CHEMBL3542282;­CHEMBL3542283) 0.956(CHEMBL3542263) 0.951(DB00917 )
Teratogen	0.996(DB06781) 0.995(DB00394;­DB14669;­METXBIODB01048) 0.994(DB00764)	0.996(DBMET00837) 0.995(DBMET02589;­DBMET02590) 0.994(CHEMBL4525798;­DBMET02361;­DBMET02913 )
UDP-glucuronosyltransferase substrate	0.999(METXBIODB02451) 0.994(DB04630) 0.992(METXBIODB02206)	0.999(DBMET00862) 0.994(DBMET03144) 0.992(DBMET00827;­DBMET01587;­DBMET02862 )
GABA C receptor rho-3 antagonist	0.850(DB00829) 0.825(METXBIODB03108) 0.824(METXBIODB02828)	0.824(CHEMBL117) 0.806(DBMET00980) 0.792(DB14028;­DBMET00831 )
Embryotoxic	0.996(DB06781) 0.995(DB00394;­DB14669;­METXBIODB01048) 0.994(CHEMBL1370;­DB00764;­DB01222;­METXBIODB01745)	0.996(DBMET00837) 0.995(DBMET02589;­DBMET02590) 0.994(CHEMBL4525798;­DBMET02361;­DBMET02904;­DBMET02913 )
Uric acid excretion stimulant	0.790(DB04854) 0.784(DB01138) 0.680(METXBIODB01647)	0.960(DBMET01434) 0.784(METXBIODB01648) 0.751(DBMET03281 )
CYP2C9 inhibitor	0.952(DB08881) 0.888(DB00582) 0.820(DB13345)	0.862(DBMET00072) 0.838(DBMET02840) 0.835(CHEMBL3526986 )
FMO1 substrate	0.974(METXBIODB02033) 0.970(CHEMBL1064;­DB00641;­METXBIODB01371;­METXBIODB01928) 0.960(METXBIODB02065)	0.967(CHEMBL3544679) 0.956(CHEMBL3544664) 0.948(DBMET01002 )
Pancreatic disorders treatment	0.914(CHEMBL1201772;­DB06209) 0.871(DB00347) 0.858(DB09031)	0.966(CHEMBL3527031;­DBMET00096) 0.721(DBMET03117) 0.696(DBMET03118 )
Platelet aggregation inhibitor	0.986(DB09282) 0.975(METXBIODB01752) 0.974(METXBIODB00481;­METXBIODB01307)	0.993(METXBIODB00716) 0.988(DB13400) 0.975(CHEMBL3526430 )
Autoimmune disorders treatment	0.992(DB01294) 0.963(DB08877) 0.951(DB11703)	0.957(DBMET03261) 0.938(CHEMBL219497;­DBMET00655;­DBMET02004;­DBMET03581) 0.929(DBMET03262 )
Non-steroidal antiinflammatory agent	0.980(DB00605) 0.921(DB00533) 0.883(METXBIODB02492)	0.987(DBMET01003) 0.978(CHEMBL3544878;­METXBIODB02493) 0.967(DBMET00813 )
Antiarthritic	0.985(CHEMBL1473;­DB00588) 0.984(DB08906) 0.976(DB11921)	0.992(METXBIODB02429) 0.981(DBMET02573) 0.971(CHEMBL3542318 )
UDP-N-acetylglucosamine 1-carboxyvinyltransferase inhibitor	0.560(DB00130) 0.522(DB09144) 0.515(DB06819)	0.850(DB01861;­DB03501) 0.758(CHEMBL590981;­DBMET03589) 0.745(CHEMBL1774;­CHEMBL474163;­DBMET02000;­DBMET03586;­DBMET03590 )
Histamine release inhibitor	0.975(DB13751) 0.841(METXBIODB03137) 0.840(CHEMBL151;­METXBIODB03066)	0.959(METXBIODB03068) 0.950(METXBIODB02705) 0.948(METXBIODB02137 )
Immunosuppressant	0.991(CHEMBL269732;­DB00864;­METXBIODB00828) 0.988(CHEMBL413;­DB00877;­METXBIODB01375) 0.965(METXBIODB00817)	0.989(CHEMBL3544693;­CHEMBL3544708;­DBMET00390;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.988(DBMET00628;­METXBIODB00818) 0.987(CHEMBL3544688;­CHEMBL3544838;­DBMET01749;­METXBIODB01377 )
Antipruritic, allergic	0.993(CHEMBL1473;­DB00588) 0.987(DB06781) 0.982(DB08906)	0.987(DBMET00837) 0.947(DBMET02589) 0.937(DBMET02590 )
Electrolyte absorption antagonist	0.882(DB00695) 0.765(DB00808) 0.649(DB04831;­METXBIODB01466)	0.751(DBMET00729) 0.706(DBMET01334) 0.659(DBMET01337 )
GST M1-1 substrate	0.975(METXBIODB02869) 0.956(DB00929) 0.900(METXBIODB03125)	0.975(METXBIODB00355) 0.930(METXBIODB01656) 0.918(DBMET02637 )
Ankylosing spondylitis treatment	0.516(DB05676) 0.444(DB01097;­METXBIODB01809) 0.366(CHEMBL101)	0.509(DBMET00219) 0.480(DBMET01392) 0.473(CHEMBL3526838 )
Antibacterial	0.992(DB00778;­METXBIODB01286) 0.982(CHEMBL532;­DB00199) 0.976(CHEMBL1741;­DB01211;­METXBIODB00619)	0.989(METXBIODB01287) 0.986(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.984(CHEMBL3706534 )
Cytostatic	0.990(DB00570) 0.988(CHEMBL417;­CHEMBL53463;­DB00997) 0.987(DB00773;­METXBIODB00808)	0.993(CHEMBL3508142) 0.992(CHEMBL3508145) 0.991(DBMET00853 )
Spasmolytic	0.994(METXBIODB00475) 0.977(DB13345) 0.969(METXBIODB00334)	0.995(METXBIODB00477) 0.971(METXBIODB00336) 0.953(METXBIODB00476 )
Carcinogenic, group 3	0.994(METXBIODB01256) 0.993(DB01181;­METXBIODB00963) 0.989(METXBIODB01359)	0.997(METXBIODB01257) 0.995(METXBIODB01362) 0.992(METXBIODB01258 )
Platelet antagonist	0.984(METXBIODB01752) 0.979(DB01240) 0.977(CHEMBL1201772;­DB06209)	0.987(METXBIODB00716) 0.984(CHEMBL3526430) 0.978(CHEMBL3526431 )
5 Hydroxytryptamine uptake stimulant	0.753(DB00182;­DB01576;­METXBIODB01904) 0.721(METXBIODB00536) 0.714(METXBIODB00025)	0.797(CHEMBL3250637;­DBMET00785;­METXBIODB00120) 0.785(CHEMBL3544653;­DBMET00704;­METXBIODB00538) 0.753(DBMET00621;­METXBIODB01525;­METXBIODB01529;­METXBIODB01799 )
Carcinogenic	0.990(CHEMBL1370;­DB01222;­METXBIODB01745) 0.985(DB01181;­METXBIODB00694;­METXBIODB00963) 0.984(CHEMBL1504)	0.995(METXBIODB01257;­METXBIODB02752) 0.993(METXBIODB02751) 0.991(METXBIODB01362 )
UGT2B7 substrate	0.983(DB04630) 0.972(DB00741;­METXBIODB01729) 0.971(DB00921)	0.982(DBMET02855;­DBMET02858) 0.972(DBMET02856) 0.968(DBMET02900;­DBMET02901;­DBMET02902 )
CTGF expression inhibitor	0.962(CHEMBL160;­DB00091) 0.940(CHEMBL691;­DB00977;­METXBIODB01784) 0.928(DB00605)	0.953(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.952(CHEMBL3544879) 0.947(CHEMBL1614648 )
Abortion inducer	0.971(METXBIODB01739) 0.963(DB00929) 0.960(METXBIODB01134)	0.967(DB00917) 0.960(DBMET02637) 0.936(DBMET02086 )
Antihypertensive	0.993(DB00727) 0.987(DB06154;­DB09282) 0.986(CHEMBL191)	0.993(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.991(DB13400) 0.987(DBMET00009;­DBMET00303 )
Sedative	0.982(METXBIODB01912) 0.973(DB00921) 0.965(DB01452)	0.995(DBMET00176;­METXBIODB02676) 0.992(METXBIODB02827) 0.989(METXBIODB00483 )
Cyclooxygenase 1 inhibitor	0.972(DB00727) 0.955(DB00533) 0.936(METXBIODB01002)	0.972(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.935(METXBIODB01003) 0.841(DBMET00161;­DBMET01344 )
Ca2+/calmodulin-dependent protein kinase kinase A inhibitor	0.859(DB06595) 0.671(DB12874) 0.670(DB00398)	0.785(DBMET01441) 0.700(DBMET01440) 0.641(DBMET03531 )
Cholesterol antagonist	0.960(DB01586;­METXBIODB00939) 0.956(METXBIODB01980) 0.948(DB02659;­METXBIODB00251)	0.966(DBMET00553) 0.961(DBMET00592;­METXBIODB02280) 0.960(DB06777 )
Ferrochelatase inhibitor	0.636(DB03766) 0.617(METXBIODB01209) 0.609(DB03793;­METXBIODB02476)	0.640(DBMET00510) 0.636(DBMET02012) 0.609(DBMET01437 )
P-glycoprotein inhibitor	0.941(CHEMBL428647;­DB01229) 0.938(DB06772) 0.931(METXBIODB01414)	0.936(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.934(DBMET00998) 0.929(DBMET00633 )
Gastrin inhibitor	0.837(DB00929) 0.675(DB00770) 0.656(CHEMBL1783834)	0.899(DBMET02637) 0.747(DB00917) 0.675(DBMET02086 )
Cyclooxygenase inhibitor	0.977(DB00533) 0.976(DB00727) 0.873(DB06154)	0.976(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.952(DBMET00169;­DBMET01838) 0.834(DBMET01003 )
Septic shock treatment	0.770(DB05676) 0.743(DB00581) 0.691(METXBIODB02587)	0.823(DBMET02708) 0.794(DBMET02625) 0.791(DBMET01392 )
GST P1-1 substrate	0.963(DB00929) 0.955(DB00770) 0.904(METXBIODB03135)	0.973(DB00917) 0.961(DBMET02637) 0.955(DBMET02086 )
Antiparkinsonian, rigidity relieving	0.956(CHEMBL71;­DB00477;­METXBIODB00583) 0.952(DB00420) 0.951(CHEMBL643;­DB01069;­METXBIODB02397)	0.934(DBMET02437) 0.873(DBMET00051;­METXBIODB00392) 0.870(METXBIODB00127 )
Phospholipase A2 inhibitor	0.681(DB09031) 0.544(DB00755;­DB00982;­METXBIODB00937) 0.491(METXBIODB00762)	0.561(DBMET01594;­DBMET01595;­DBMET01596;­METXBIODB00408;­METXBIODB00409;­METXBIODB00410) 0.544(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.521(CHEMBL3706517 )
Tyrosine 3 hydroxylase inhibitor	0.937(CHEMBL459;­DB00968) 0.928(DB00279;­METXBIODB02434) 0.925(DB00451;­DB00509;­METXBIODB02811)	0.935(DBMET02273) 0.934(DBMET02274) 0.926(DBMET02578 )
Caspase 9 stimulant	0.952(CHEMBL1783834) 0.927(METXBIODB02194) 0.924(METXBIODB03141)	0.939(CHEMBL3526295) 0.938(METXBIODB02872) 0.936(CHEMBL3542278;­CHEMBL3542282;­CHEMBL3542283;­CHEMBL3542372 )
Antidiarrheal	1.000(DB13960) 0.999(DB01294) 0.847(CHEMBL104)	0.829(DBMET02617) 0.822(DBMET00321;­METXBIODB01140) 0.812(DBMET00427;­DBMET02514 )
Flavin-containing monooxygenase substrate	0.989(DB00863;­METXBIODB01235;­METXBIODB02033) 0.988(METXBIODB01928) 0.984(CHEMBL1064;­DB00641;­METXBIODB01359;­METXBIODB01371)	0.980(DBMET00506) 0.979(CHEMBL3544679) 0.978(DBMET00486 )
Antituberculosic	0.992(DB05154) 0.986(DB11637) 0.896(DB08903)	0.928(DBMET00726) 0.900(CHEMBL3544543) 0.888(METXBIODB02328 )
Pneumotoxic	0.966(CHEMBL633;­DB01118) 0.948(DB00907;­METXBIODB00058;­METXBIODB01359) 0.902(METXBIODB01256)	0.966(CHEMBL4525130;­CHEMBL4525131;­CHEMBL4525132;­CHEMBL4525133;­CHEMBL4525134;­CHEMBL4525135;­CHEMBL4525136;­CHEMBL4525137;­CHEMBL4525138) 0.963(CHEMBL3526948) 0.953(CHEMBL3526986 )
Antiulcerative	0.997(DB01294) 0.967(CHEMBL1503;­DB00338;­DB00736;­METXBIODB00771) 0.959(CHEMBL902;­DB00927)	0.954(DBMET00186;­DBMET01657;­METXBIODB00774) 0.949(DBMET02952) 0.938(DBMET02637 )
Antihypotensive	0.937(DB09059) 0.861(CHEMBL3527416) 0.842(DB00687)	0.868(CHEMBL3526995;­METXBIODB01734) 0.861(CHEMBL4525115) 0.858(CHEMBL3526455 )
Anesthetic general	0.962(DB00390) 0.947(METXBIODB00730) 0.940(DB00802)	0.962(DBMET02502;­METXBIODB00731) 0.911(DBMET03598;­DBMET03599) 0.905(DBMET01727;­METXBIODB01197 )
Antiglaucomic	0.993(DB00869) 0.987(DB01194) 0.965(DB08819)	0.995(DBMET03010) 0.993(DBMET03671) 0.967(DBMET00481 )
Sodium/bile acid cotransporter inhibitor	0.915(DB02659;­METXBIODB00251) 0.907(METXBIODB01504) 0.897(DB01586;­METXBIODB00939)	0.897(DB06777) 0.870(METXBIODB01505) 0.832(METXBIODB00252 )
5 Hydroxytryptamine 1E antagonist	0.934(DB00669) 0.741(METXBIODB01089) 0.688(DB06148;­METXBIODB01228;­METXBIODB01848)	0.709(DBMET01362) 0.706(DBMET01361;­METXBIODB01090) 0.684(DBMET01824 )
Antimycobacterial	0.993(DB05154) 0.985(DB11637) 0.926(CHEMBL374478)	0.934(CHEMBL3323549) 0.928(CHEMBL446290) 0.927(DBMET00726;­DBMET02189 )
Interleukin 2 agonist	0.820(CHEMBL160;­DB00091) 0.797(METXBIODB00667) 0.768(DB00480)	0.817(CHEMBL3544879) 0.805(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.802(CHEMBL3544638 )
FMO3 substrate	0.985(DB00863;­METXBIODB01235) 0.957(METXBIODB01341) 0.934(DB00518)	0.969(DBMET00506) 0.968(DBMET00486) 0.967(DBMET01735;­METXBIODB01236 )
Thioredoxin glutathione reductase inhibitor	0.889(METXBIODB00858) 0.824(METXBIODB02308) 0.779(DB00993)	0.901(CHEMBL3544542) 0.893(METXBIODB01072) 0.846(METXBIODB00089 )
Diuretic	0.981(CHEMBL1393;­DB00421) 0.969(DB00700) 0.953(DB01395)	0.943(CHEMBL3544705;­DBMET02483) 0.894(DBMET02484;­DBMET02485) 0.892(DBMET01655 )
Vasodilator, peripheral	0.991(DB01240) 0.975(DB00770) 0.973(DB11660)	0.986(DB00917) 0.975(DBMET02086) 0.959(DBMET02588 )
Uterine stimulant	0.625(DB09059) 0.519(DB00929) 0.493(DB00770;­DB13345)	0.532(DB00917) 0.513(DBMET02637) 0.493(DBMET02086 )
Insulysin inhibitor	0.521(DB11296) 0.470(METXBIODB01173) 0.451(DB00121)	0.568(CHEMBL3526373) 0.506(CHEMBL3544779) 0.491(DBMET03072 )
Antialcoholic	0.992(DB00921) 0.985(DB06230) 0.961(DB00704)	0.952(DBMET00176) 0.944(CHEMBL3526502) 0.935(DBMET00760;­DBMET01858 )
Antirickettsial	0.956(METXBIODB01048) 0.952(CHEMBL532;­DB00199) 0.945(CHEMBL1741;­DB01211;­METXBIODB00619)	0.921(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.917(METXBIODB01049) 0.912(CHEMBL1947257 )
GABA C receptor antagonist	0.778(METXBIODB01947) 0.503(CHEMBL1046;­DB00513) 0.465(METXBIODB02828)	0.576(METXBIODB01948) 0.556(METXBIODB00005) 0.466(DB14028;­DBMET00831;­DBMET01434 )
Antiparkinsonian, tremor relieving	0.994(METXBIODB00475) 0.976(DB00424) 0.843(DB00245)	0.991(METXBIODB00477) 0.978(METXBIODB00476) 0.976(DBMET03252;­DBMET03253 )
Anticoagulant	0.933(CHEMBL169901;­DB04840) 0.865(DB06695) 0.677(DB12364)	0.946(DBMET01535) 0.879(CHEMBL1710849;­DBMET01641) 0.876(DB14726 )
Prostaglandin dehydrogenase inhibitor	0.673(METXBIODB02548) 0.602(METXBIODB02153) 0.573(METXBIODB02879)	0.857(CHEMBL3527192) 0.830(CHEMBL3544771) 0.661(DBMET03309 )
Protein kinase stimulant	0.692(DB00385) 0.689(METXBIODB00677) 0.669(CHEMBL1783834)	0.670(CHEMBL3542282;­CHEMBL3542283) 0.649(CHEMBL3526295) 0.639(CHEMBL3526454 )
Sphingosine 1-phosphate receptor 5 antagonist	0.400(DB08868) 0.341(DB05016) 0.269(DB01050;­DB09213;­METXBIODB00134;­METXBIODB01970)	0.952(DBMET03096) 0.281(METXBIODB00722) 0.280(METXBIODB00593 )
Raynaud's phenomenon treatment	0.542(DB00374) 0.526(DB00770) 0.473(DB00727)	0.526(DBMET02086) 0.486(DBMET03614) 0.473(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598 )
UGT2B10 substrate	0.966(DB04630) 0.818(METXBIODB02212) 0.737(METXBIODB02214)	0.838(DBMET02837) 0.818(METXBIODB02213) 0.806(DBMET03007 )
Succinate dehydrogenase inhibitor	0.970(METXBIODB01756) 0.883(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450) 0.776(DB03766)	0.978(METXBIODB01757) 0.913(CHEMBL3706508;­DBMET01107) 0.911(DBMET01108 )
Osteoarthritis treatment	0.935(DB00727) 0.916(DB06725) 0.910(METXBIODB01002)	0.935(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.913(METXBIODB01003) 0.861(DBMET00161 )
Antipruritic, non-allergic	0.985(CHEMBL1473;­DB00588) 0.981(DB08906) 0.977(DB06781)	0.977(DBMET00837) 0.914(DBMET02589) 0.897(DBMET02590 )
GABA C receptor rho-2 antagonist	0.675(DB00829) 0.661(METXBIODB02828) 0.645(METXBIODB03108)	0.661(CHEMBL117) 0.609(CHEMBL210635) 0.586(CHEMBL214321;­CHEMBL90568 )
Interleukin agonist	0.988(CHEMBL160;­DB00091) 0.985(CHEMBL269732;­DB00864;­METXBIODB00828) 0.947(METXBIODB00831)	0.986(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.985(CHEMBL2407580;­DBMET00359) 0.984(CHEMBL3544879 )
Antiviral (Poxvirus)	0.951(DB12151) 0.853(DB00718) 0.837(DB09299)	0.960(DBMET03374) 0.917(CHEMBL3526610) 0.915(DBMET00485;­DBMET03265 )
Sphingosine 1-phosphate receptor 4 antagonist	0.589(DB08868) 0.356(DB05016) 0.347(DB12016)	0.968(DBMET03096) 0.376(METXBIODB00722) 0.374(METXBIODB00593 )
Acetylcholine release stimulant	0.353(METXBIODB02226) 0.345(DB09173) 0.338(METXBIODB00196;­METXBIODB02228)	0.516(DBMET00511;­METXBIODB03127) 0.466(DBMET00788) 0.330(DBMET00709 )
CNS active muscle relaxant	0.934(CHEMBL1233;­DB00395) 0.890(DB13872) 0.810(METXBIODB00635)	0.825(CHEMBL3706483) 0.779(METXBIODB00845) 0.758(CHEMBL979 )
Carcinogenic, group 1	0.993(DB00773;­METXBIODB00808) 0.987(CHEMBL88;­DB00531;­METXBIODB00960) 0.978(CHEMBL160;­DB00091)	0.992(DBMET00367;­DBMET01264;­METXBIODB00809) 0.988(DBMET01265) 0.987(DBMET01683 )
Arachidonic acid antagonist	0.982(CHEMBL1473;­DB00588) 0.965(DB06781) 0.963(DB08906)	0.965(DBMET00837) 0.875(DBMET02589) 0.865(DBMET02590 )
Mutagenic	0.993(DB01181;­METXBIODB00963) 0.991(CHEMBL1117;­CHEMBL417;­CHEMBL53463;­DB00997) 0.990(METXBIODB03049)	0.995(CHEMBL731;­DBMET00019;­METXBIODB01257) 0.993(CHEMBL3508145) 0.992(CHEMBL1593;­DBMET00658;­METXBIODB01362 )
Psychostimulant	0.981(DB01452) 0.968(DB00295;­DB00318;­DB00570;­METXBIODB00641;­METXBIODB00642) 0.962(METXBIODB01535)	0.984(DBMET01172) 0.980(METXBIODB02827) 0.971(DB06409;­DBMET00660;­METXBIODB02727;­METXBIODB02826 )
Photosensitizer	0.636(METXBIODB01034) 0.626(METXBIODB00452) 0.611(METXBIODB01203)	0.577(METXBIODB02154) 0.506(CHEMBL3526454) 0.487(METXBIODB02166 )
Cathepsin H inhibitor	0.795(DB06670) 0.411(DB01255) 0.325(DB11296)	0.831(DBMET01475) 0.577(DBMET01472) 0.571(CHEMBL3526373 )
Muscle relaxant	0.931(DB01062;­METXBIODB00150) 0.923(METXBIODB00481) 0.914(DB00690)	0.940(DBMET00882) 0.908(DBMET00381;­METXBIODB00153) 0.906(METXBIODB00482 )
Prolactin inhibitor	0.943(DB13345) 0.922(METXBIODB00475) 0.822(DB00248)	0.833(METXBIODB00477) 0.803(METXBIODB00476) 0.744(DBMET02090 )
Lipocortins synthesis antagonist	0.917(DB04839) 0.884(DB00834) 0.844(METXBIODB01044)	0.903(DBMET00672) 0.892(CHEMBL3544565) 0.885(METXBIODB02005 )
Neurotrophic factor enhancer	0.692(DB05087) 0.640(DB02789;­METXBIODB01189) 0.636(DB11217)	0.661(METXBIODB02147) 0.650(METXBIODB02216) 0.630(METXBIODB02148 )
Skeletal muscle relaxant	0.908(DB13872) 0.896(CHEMBL1233;­DB00395) 0.893(METXBIODB00635)	0.932(DBMET00882) 0.893(CHEMBL3706483) 0.863(DBMET03600;­METXBIODB00217 )
GST T1-1 substrate	0.978(DB00493) 0.728(METXBIODB03119) 0.708(METXBIODB02349)	0.690(CHEMBL276521) 0.602(METXBIODB01097) 0.584(METXBIODB00485 )
TRPA1 agonist	0.946(DB00470) 0.923(CHEMBL428647;­DB01229) 0.856(METXBIODB00199)	0.943(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.906(DBMET01221) 0.819(METXBIODB00716 )
Sphingosine 1-phosphate receptor 2 antagonist	0.437(DB08868) 0.328(CHEMBL54;­DB00502) 0.323(METXBIODB00517)	0.860(DBMET03096) 0.328(CHEMBL4525086;­METXBIODB00519) 0.323(CHEMBL1036;­DBMET00104 )
Cyclooxygenase 2 inhibitor	0.974(DB00727) 0.969(DB00533) 0.848(DB06154)	0.974(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.939(DBMET00169;­DBMET01838) 0.767(DBMET01294 )
TNF expression inhibitor	0.995(CHEMBL1370;­CHEMBL92;­DB01222;­DB01248;­METXBIODB01745) 0.994(CHEMBL1504;­CHEMBL269732;­DB00864;­METXBIODB00828) 0.993(DB06772)	0.995(CHEMBL3542373;­CHEMBL3544693;­CHEMBL3706530;­DBMET00390;­DBMET00633;­DBMET00998;­DBMET00999;­DBMET01649;­DBMET02914) 0.994(CHEMBL3542193;­CHEMBL3542395;­CHEMBL3544838;­DBMET00476;­DBMET02915;­METXBIODB01746) 0.993(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830 )
Ca2+-transporting ATPase inhibitor	0.405(CHEMBL417;­CHEMBL53463;­DB00997) 0.403(CHEMBL1117) 0.376(CHEMBL178;­DB00694)	0.351(CHEMBL3544590) 0.332(CHEMBL3508145) 0.329(CHEMBL3508141;­CHEMBL3508146;­DBMET00647 )
Antiviral (West Nile virus)	0.376(CHEMBL184) 0.366(DB01255) 0.364(DB00432)	0.380(DBMET00720) 0.363(DBMET03515) 0.350(DBMET02067 )
Cell wall synthesis inhibitor	0.975(DB06590) 0.939(DB00493) 0.920(DB01413)	0.855(CHEMBL3526531) 0.815(DBMET00646) 0.793(DBMET03003 )
Excitatory amino acid transporter EAAC1 inhibitor	0.678(DB00130) 0.612(DB00129) 0.609(METXBIODB02624)	0.685(DB00142) 0.587(DB09269;­DBMET01431;­METXBIODB03146) 0.586(DB00123 )
Hair growth stimulant	0.940(DB00287) 0.919(DB00741;­METXBIODB01729) 0.911(CHEMBL710;­DB01216)	0.944(DB00917) 0.928(DBMET02900;­DBMET02901) 0.927(METXBIODB00940 )
Creatine kinase inhibitor	0.906(METXBIODB03137) 0.893(METXBIODB01399) 0.857(METXBIODB02136)	0.925(METXBIODB03144) 0.777(DBMET00253) 0.749(CHEMBL117 )
Androgen agonist	0.994(METXBIODB00694) 0.990(DB00294;­DB06781) 0.986(METXBIODB02972)	0.994(DBMET00723;­DBMET00724;­DBMET01642;­DBMET01643;­METXBIODB00695;­METXBIODB02752) 0.990(DBMET00837) 0.986(DBMET01371 )
Neurotensin receptor agonist	0.357(DB01255) 0.337(DB00129) 0.316(DB11296)	0.755(CHEMBL3526373) 0.445(DBMET02065) 0.431(DBMET00502 )
SULT1A3 substrate	0.960(METXBIODB03137) 0.957(DB01001) 0.948(METXBIODB02136)	0.976(DBMET00975;­DBMET01000) 0.968(CHEMBL1208633) 0.965(DBMET00565;­DBMET00573;­DBMET02448;­DBMET02449;­METXBIODB02238 )
GABA C receptor agonist	0.926(CHEMBL1046;­DB00513) 0.843(DB00129) 0.734(DB03766)	0.862(DB01677) 0.859(DBMET01483) 0.857(DBMET01477 )
Acaricide	0.958(DB11431) 0.948(METXBIODB00942) 0.935(DB13600;­METXBIODB01687)	0.986(DBMET03414) 0.981(DBMET03415) 0.948(DBMET02119;­DBMET02120 )
Calpain inhibitor	0.385(DB06218) 0.384(DB09292) 0.332(DB00121)	0.527(CHEMBL3544766) 0.454(DBMET01081) 0.418(DBMET02065 )
SULT1A1 substrate	0.955(CHEMBL691;­DB00977;­METXBIODB01784) 0.944(DB00367) 0.943(DB00279;­METXBIODB02434)	0.985(CHEMBL1614648) 0.976(DBMET00567) 0.973(DBMET00559 )
Interferon gamma antagonist	0.991(CHEMBL269732;­DB00864;­METXBIODB00828) 0.984(METXBIODB00831) 0.902(CHEMBL1370;­DB01222;­METXBIODB01745)	0.990(CHEMBL3544693;­CHEMBL3544708;­DBMET00390;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.987(CHEMBL3544838) 0.984(CHEMBL3544602;­CHEMBL3544709;­CHEMBL3544837;­METXBIODB00832 )
Antileprosy	0.990(CHEMBL374478) 0.963(DB11753) 0.938(METXBIODB01265)	0.986(CHEMBL446290) 0.884(DBMET02189) 0.829(METXBIODB01268 )
Glycine receptor antagonist	0.661(CHEMBL1783834) 0.553(METXBIODB01947) 0.502(DB02789;­METXBIODB01189)	0.732(DBMET00511;­METXBIODB03127) 0.714(DBMET00518) 0.594(DBMET00500 )
DNA polymerase I inhibitor	0.600(DB02377) 0.594(DB00352) 0.585(METXBIODB02136)	0.807(DBMET01175) 0.771(DBMET01174) 0.770(DBMET01177 )
RNA-directed DNA polymerase inhibitor	0.966(DB11753) 0.953(DB00300) 0.921(CHEMBL1076930)	0.996(CHEMBL3526610) 0.993(DBMET00677) 0.987(DBMET01157 )
Calpain 2 inhibitor	0.560(DB00499) 0.535(DB06218) 0.511(CHEMBL2095212;­DB08893)	0.644(CHEMBL3544766) 0.623(DBMET01081) 0.533(DBMET03168 )
Glutamate (mGluR7) antagonist	0.170(CHEMBL109;­DB00313;­METXBIODB01559) 0.167(METXBIODB01812) 0.161(METXBIODB02611)	0.152(DBMET02273) 0.149(CHEMBL3527191;­CHEMBL3706509;­DBMET01108;­DBMET01109;­DBMET02274) 0.144(DBMET01695 )
Antispirochetal	0.978(CHEMBL532;­DB00199) 0.975(CHEMBL1741;­DB01211;­METXBIODB00619) 0.963(METXBIODB01048)	0.964(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.961(CHEMBL2063468;­DBMET01656) 0.956(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
Vasodilator, coronary	0.989(CHEMBL633;­DB01118) 0.985(CHEMBL1064;­DB00641;­METXBIODB01371) 0.980(CHEMBL503;­DB00227;­DB00343;­METXBIODB01008)	0.991(CHEMBL3526948) 0.989(CHEMBL4525130;­CHEMBL4525131;­CHEMBL4525132;­CHEMBL4525133;­CHEMBL4525134;­CHEMBL4525135;­CHEMBL4525136;­CHEMBL4525137;­CHEMBL4525138) 0.987(CHEMBL1600;­DBMET00012 )
Phospholipase C inhibitor	0.957(DB02659;­METXBIODB00251) 0.947(METXBIODB00249) 0.940(DB01586;­METXBIODB00939)	0.940(DB06777) 0.936(METXBIODB00250) 0.923(DBMET03598 )
Peroxidase inhibitor	0.902(DB00126) 0.892(CHEMBL49563;­DB00163) 0.884(METXBIODB02879)	0.892(DBMET00503) 0.860(DBMET02035;­DBMET02036;­DBMET02037;­DBMET02311;­DBMET02320;­DBMET02321) 0.858(DBMET02038;­DBMET02322 )
GABA C receptor rho-1 antagonist	0.438(METXBIODB02828) 0.419(METXBIODB03108) 0.386(CHEMBL1046;­DB00513)	0.438(CHEMBL117) 0.388(METXBIODB00005) 0.357(CHEMBL3527154 )
Antifungal enhancer	0.875(DB11431) 0.848(METXBIODB00942) 0.775(CHEMBL532;­DB00199)	0.988(DBMET03415) 0.981(DBMET03414) 0.863(METXBIODB00943 )
Cholesterol synthesis inhibitor	0.821(CHEMBL503;­DB00227;­METXBIODB01008) 0.820(CHEMBL1064;­DB00641;­METXBIODB01371) 0.806(DB00175)	0.814(CHEMBL3544679) 0.809(CHEMBL3544664) 0.806(DBMET01699;­DBMET02472 )
Xanthine oxidase inhibitor	0.984(DB04854) 0.968(CHEMBL3527416) 0.942(METXBIODB03141)	0.994(DBMET03278) 0.993(CHEMBL3526749;­CHEMBL3526994) 0.991(CHEMBL3526996 )
Electron transport complex I inhibitor	0.843(METXBIODB01756) 0.583(DB09081) 0.563(DB01022)	0.785(METXBIODB01757) 0.730(METXBIODB02098) 0.686(METXBIODB00665 )
Hearing loss treatment	0.520(DB01234;­METXBIODB00696) 0.500(DB14669) 0.462(DB01132)	0.520(DB00443) 0.473(CHEMBL3706469) 0.381(DB00166 )
Lipoxygenase inhibitor	0.946(DB00744) 0.939(METXBIODB00090;­METXBIODB03094) 0.877(CHEMBL2105653)	0.866(DBMET02036;­DBMET02320) 0.859(METXBIODB00659) 0.847(DBMET02038;­DBMET02322 )
CF transmembrane conductance regulator agonist	0.808(DB08820) 0.635(METXBIODB00464;­METXBIODB02430) 0.624(DB01645;­METXBIODB00465)	0.654(DBMET02319) 0.616(DBMET02318) 0.558(METXBIODB00928 )
CYP2B6 inhibitor	0.871(CHEMBL633;­DB01118) 0.832(DB01611) 0.827(DB00608;­METXBIODB00114)	0.871(CHEMBL4525130;­CHEMBL4525131;­CHEMBL4525132;­CHEMBL4525133;­CHEMBL4525134;­CHEMBL4525135;­CHEMBL4525136;­CHEMBL4525137;­CHEMBL4525138) 0.863(CHEMBL3526948) 0.827(CHEMBL3527235 )
AR expression inhibitor	0.989(METXBIODB00715) 0.987(DB00957) 0.981(DB04839)	0.987(DBMET01476) 0.984(DBMET03015) 0.980(DB09389 )
Antiprotozoal (Coccidial)	0.853(METXBIODB00454) 0.850(DB06697) 0.831(DB11638)	0.831(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.819(METXBIODB00455) 0.777(DBMET01913;­DBMET03143 )
Sphingosine 1-phosphate receptor 4 agonist	0.792(DB12016) 0.729(DB12612) 0.489(DB08868)	0.965(DBMET03096) 0.859(DBMET03312) 0.603(DBMET03311 )
Histone acetyltransferase inhibitor	0.631(DB06176) 0.499(DB01015;­METXBIODB01391) 0.458(METXBIODB02919)	0.562(DBMET03512) 0.458(DBMET01049) 0.421(DBMET00016 )
Antidote, mercury	0.402(METXBIODB00446) 0.382(METXBIODB00715) 0.363(DB00763)	0.650(DBMET01434) 0.426(CHEMBL2158192;­DBMET01416) 0.356(DBMET00503 )
Interleukin 5 antagonist	0.720(CHEMBL269732;­DB00864;­METXBIODB00828) 0.690(CHEMBL1370;­DB01222;­METXBIODB01745) 0.687(METXBIODB00831)	0.718(CHEMBL3544693;­DBMET00390) 0.716(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.714(CHEMBL3544838 )
Anabolic	0.990(METXBIODB00694) 0.987(DB00294) 0.983(METXBIODB02972)	0.994(METXBIODB02752) 0.990(DBMET00723;­DBMET00724;­DBMET01642;­DBMET01643;­METXBIODB00695) 0.987(CHEMBL3638297;­CHEMBL3638299;­CHEMBL3638301;­CHEMBL3638303 )
Sphingomyelinase inhibitor	0.677(DB09031) 0.483(DB01142;­METXBIODB00751;­METXBIODB02406) 0.449(METXBIODB00752)	0.478(DBMET02089) 0.449(DBMET00315) 0.406(DBMET00873;­METXBIODB00753 )
Calcium channel activator	0.807(CHEMBL193;­DB01115) 0.795(CHEMBL846;­DB00136) 0.787(METXBIODB00247)	0.790(DBMET01832) 0.758(DBMET02975) 0.749(DBMET01949 )
Vanilloid 4 agonist	0.167(METXBIODB02515) 0.150(CHEMBL498;­DB00672) 0.147(METXBIODB01129)	0.174(DBMET01607;­DBMET01608;­DBMET01609;­DBMET01610;­METXBIODB00421;­METXBIODB00422;­METXBIODB00423;­METXBIODB00424) 0.159(DBMET01593;­DBMET01606;­DBMET02087;­METXBIODB00407;­METXBIODB00420) 0.153(DBMET01601;­METXBIODB00415 )
Cyclic AMP phosphodiesterase inhibitor	0.921(DB12406) 0.902(CHEMBL628;­DB00806) 0.890(DB00922)	0.925(DBMET03235) 0.921(CHEMBL1514176;­DBMET03229) 0.907(CHEMBL3544675;­DBMET03234 )
Falcipain 3 inhibitor	0.268(DB01079;­METXBIODB01419) 0.248(DB01065) 0.247(METXBIODB00946)	0.497(CHEMBL3526373) 0.265(CHEMBL3544766) 0.252(CHEMBL1442231;­METXBIODB01420 )
Aldehyde oxidase inhibitor	0.985(CHEMBL691;­DB00977;­METXBIODB01784) 0.982(DB01357) 0.974(DB00850)	0.985(CHEMBL1627649;­CHEMBL3544577;­DBMET00457;­DBMET03022) 0.984(CHEMBL3544698;­DBMET00366;­METXBIODB01785) 0.983(DBMET03024 )
CC chemokine 5 receptor agonist	0.180(DB00704) 0.170(DB00813;­METXBIODB00823) 0.169(DB06230)	0.235(DBMET00081) 0.178(METXBIODB00187) 0.176(DBMET02691 )
Eye irritation, high	0.997(CHEMBL1473;­DB00588) 0.996(DB06781) 0.995(CHEMBL1504;­CHEMBL1512;­DB01181;­DB08819;­METXBIODB00963)	0.996(DBMET00837) 0.994(DBMET00883) 0.992(CHEMBL3542318 )
Adenylate cyclase stimulant	0.470(DB01240) 0.363(DB01001) 0.360(DB06755)	0.361(DBMET02979) 0.359(DBMET00298;­DBMET02549;­DBMET02554) 0.356(DB00523;­DBMET02046;­DBMET02444;­DBMET02548;­METXBIODB00324;­METXBIODB01253 )
Antimutagenic	0.982(CHEMBL3527416) 0.981(METXBIODB03141) 0.967(METXBIODB01398;­METXBIODB02194;­METXBIODB03058)	0.988(CHEMBL3526996) 0.985(CHEMBL3526995) 0.984(CHEMBL3526994 )
Antihypercholesterolemic	0.992(CHEMBL1064;­DB00641;­METXBIODB01371) 0.991(CHEMBL503;­DB00227;­METXBIODB01008) 0.989(METXBIODB01748)	0.996(DBMET02475) 0.995(CHEMBL3544664) 0.992(CHEMBL3544679 )
Sensitization	0.995(METXBIODB01048) 0.987(DB00410) 0.976(DB15566)	0.991(METXBIODB01049) 0.970(CHEMBL131;­DBMET00627) 0.968(CHEMBL4525798;­DBMET02913 )
Bile acid receptor antagonist	0.978(DB01586;­METXBIODB00939) 0.960(DB02659;­METXBIODB00251) 0.953(METXBIODB01980)	0.978(DB06777) 0.953(DBMET03598) 0.918(METXBIODB01981 )
Glycine receptor agonist	0.742(METXBIODB00942) 0.611(DB11431) 0.508(DB02789;­METXBIODB01189)	0.991(DBMET03414) 0.986(DBMET03415) 0.702(METXBIODB00943 )
Cyclooxygenase 3 inhibitor	0.977(DB06772) 0.967(DB13751) 0.960(CHEMBL92;­DB01248)	0.978(DBMET00998) 0.970(METXBIODB03005) 0.966(DBMET00999 )
ATPase inhibitor	0.737(METXBIODB00730) 0.671(DB00390) 0.670(METXBIODB00942)	0.834(DBMET03415) 0.814(DBMET03414) 0.692(METXBIODB00943 )
Cholesterol esterase inhibitor	0.193(METXBIODB02133) 0.179(DB00825;­METXBIODB01997;­METXBIODB02957) 0.152(METXBIODB02136)	0.193(DBMET01971) 0.147(DBMET01968;­DBMET01969;­DBMET01970) 0.113(METXBIODB01152 )
Neuropeptide Y2 antagonist	0.332(DB01255) 0.322(DB01018) 0.321(DB09173)	0.598(DBMET02065) 0.582(CHEMBL3526373) 0.331(CHEMBL3544766 )
NOS2 expression inhibitor	0.981(DB00394) 0.969(DB01234;­METXBIODB00696) 0.966(DB00764)	0.982(DBMET02589) 0.978(DBMET02590) 0.973(DBMET02591 )
NAT2 substrate	0.960(METXBIODB02653) 0.953(METXBIODB02206) 0.937(METXBIODB02319)	0.962(DBMET00301) 0.951(METXBIODB01390) 0.935(DBMET00612 )
Coagulant	0.935(DB01022) 0.835(DB00126) 0.591(CHEMBL1046;­DB00513)	0.935(DBMET00799) 0.933(DBMET03366) 0.927(DBMET03368 )
UGT2B11 substrate	0.938(DB04630) 0.880(DB00741;­METXBIODB01729) 0.736(METXBIODB02993)	0.908(DBMET02902) 0.901(DBMET02900;­DBMET02901) 0.838(DBMET02903 )
Acetylcholine M5 receptor agonist	0.450(DB00185;­METXBIODB00507) 0.220(DB01085;­METXBIODB01181) 0.218(DB01184)	0.450(DBMET00430;­DBMET00431;­DBMET00433) 0.215(DBMET03252;­DBMET03253) 0.188(METXBIODB00508 )
Toll-Like receptor 2 antagonist	0.477(DB11677) 0.435(METXBIODB03031) 0.377(DB13966)	0.626(DBMET01886;­DBMET01887) 0.449(DBMET01600;­METXBIODB00414) 0.416(DBMET01599;­METXBIODB00413 )
Analeptic	0.995(CHEMBL250785;­CHEMBL428647;­DB01229) 0.990(DB06772) 0.986(DB01183)	0.995(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.994(CHEMBL3526207;­DBMET03369) 0.993(CHEMBL517341;­DB06409;­METXBIODB02826 )
Prostaglandin F2 alpha antagonist	0.777(DB00287) 0.742(DB00905) 0.710(DB00654)	0.897(DBMET02588) 0.827(DBMET02216) 0.790(DBMET02771 )
Antifungal (Candida)	0.982(CHEMBL64391;­DB01167;­METXBIODB00524) 0.895(DB11638) 0.873(METXBIODB00454)	0.982(CHEMBL4525087;­CHEMBL4525088) 0.914(CHEMBL4525795;­DBMET00374;­METXBIODB00525) 0.895(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713 )
Chemoprotective	0.985(METXBIODB03141) 0.974(DB09298) 0.970(CHEMBL3527416)	0.993(CHEMBL3988904) 0.990(CHEMBL3542279;­CHEMBL3542281;­DBMET03632;­METXBIODB02134) 0.986(CHEMBL4106241;­METXBIODB02135 )
Vanilloid 1 agonist	0.720(METXBIODB02498) 0.693(DB14001) 0.621(DB06716)	0.645(DBMET02036;­DBMET02320) 0.636(CHEMBL3526360) 0.611(DBMET02038;­DBMET02322 )
UGT2B1 substrate	0.989(DB00921) 0.981(METXBIODB01912) 0.970(METXBIODB01980)	0.981(DBMET00174) 0.975(DB00917) 0.971(DBMET00760 )
Alpha-N-acetylglucosaminidase inhibitor	0.937(DB01914;­DB09419;­DB11735) 0.927(DB00742;­DB11195) 0.870(DB03793;­METXBIODB02476)	0.941(DBMET02088) 0.915(DBMET00488) 0.896(DBMET03076 )
Nav1.6 sodium channel blocker	0.505(METXBIODB01341) 0.494(CHEMBL643;­DB01069;­METXBIODB02397) 0.484(DB00836)	0.422(DBMET01213) 0.412(DBMET00108;­DBMET01728) 0.397(DBMET01616 )
Restless leg syndrome treatment	0.764(DB00248) 0.640(DB00451;­DB00509;­METXBIODB02811) 0.554(DB13345)	0.887(DBMET00559) 0.886(DBMET00555) 0.825(DBMET02090 )
Choleretic	0.915(DB02659;­METXBIODB00251) 0.884(DB01586;­METXBIODB00939) 0.852(METXBIODB00249)	0.979(DBMET00553) 0.970(METXBIODB02279) 0.926(METXBIODB00252 )
Growth hormone agonist	0.958(DB00121) 0.673(DB00191) 0.648(DB03852;­METXBIODB00171)	0.947(DBMET03073) 0.935(DBMET03072) 0.682(DB00166 )
Antiviral (Influenza B)	0.891(DB13997) 0.594(DB00198) 0.530(DB00640)	0.809(DB15675) 0.770(DB00171) 0.686(CHEMBL3638285 )
Interferon agonist	0.367(DB14001) 0.346(CHEMBL49563;­DB00163) 0.341(DB14002)	0.378(METXBIODB02530) 0.362(METXBIODB02462) 0.361(DBMET00509 )
Sigma receptor agonist	0.757(CHEMBL52440;­DB00514;­METXBIODB00707) 0.715(DB01074;­DB09089;­METXBIODB00067) 0.707(CHEMBL259209;­DB04896;­DB08918)	0.759(CHEMBL1254766;­DB14682;­METXBIODB00708) 0.747(DBMET01507) 0.744(DBMET01505 )
Posttraumatic stress disorder treatment	0.711(DB05087) 0.595(DB00273) 0.520(DB09059)	0.530(DBMET03442) 0.503(CHEMBL3527303) 0.475(DBMET00120;­DBMET01785 )
Immunostimulant	0.820(CHEMBL269732;­DB00864;­METXBIODB00828) 0.768(METXBIODB00831) 0.759(CHEMBL1783834)	0.963(CHEMBL3706513) 0.952(CHEMBL3706514) 0.931(CHEMBL4106241 )
Adenylate kinase inhibitor	0.630(DB00640) 0.531(DB00118) 0.462(METXBIODB01129)	0.988(DBMET03175) 0.987(DB03699) 0.979(DB02912;­DBMET03176 )
Oleamide hydrolase inhibitor	0.239(DB08887) 0.206(METXBIODB00237;­METXBIODB01309) 0.186(METXBIODB02655)	0.210(DBMET01607;­DBMET01608;­DBMET01609;­DBMET01610;­METXBIODB00421;­METXBIODB00422;­METXBIODB00423;­METXBIODB00424) 0.209(DBMET01593;­DBMET01606;­DBMET02087;­METXBIODB00407;­METXBIODB00420) 0.198(DBMET01601;­METXBIODB00415 )
Nicotinic acid receptor agonist	0.251(METXBIODB02568;­METXBIODB02799) 0.211(DB00627) 0.205(DB03793;­METXBIODB02476)	0.308(DB14132) 0.241(CHEMBL3544508;­DBMET00728) 0.205(DBMET01437 )
CYP3A4 inhibitor	0.974(CHEMBL163;­DB00503) 0.858(DB00778;­METXBIODB01286) 0.852(CHEMBL1473;­DB00588)	0.926(CHEMBL317192) 0.914(CHEMBL3544628;­DBMET00385) 0.905(CHEMBL3544832 )
Antihelmintic (Trematoda)	0.958(DB06697) 0.938(DB09274;­METXBIODB01712) 0.884(DB11638)	0.886(METXBIODB00455) 0.884(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.612(CHEMBL75589 )
Antiviral (Parainfluenza)	0.297(DB11677) 0.286(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450) 0.277(CHEMBL853)	0.286(DB03796;­DB08231;­DBMET03460) 0.282(DB03704) 0.272(DB01440 )
Antianorexic	0.756(DB00470) 0.716(DB09059) 0.671(DB01255)	0.766(CHEMBL3526373) 0.705(DBMET00120;­DBMET01785) 0.670(DBMET01221 )
Corticotropin releasing factor 2 receptor antagonist	0.184(METXBIODB00046) 0.152(DB01628) 0.145(METXBIODB00471)	0.139(DBMET02741;­DBMET03063;­METXBIODB01837;­METXBIODB02047) 0.138(DBMET02967) 0.125(DBMET03446 )
Interferon inducer	0.290(CHEMBL49563;­DB00163) 0.289(DB14001) 0.285(DB14002)	0.307(METXBIODB02530) 0.291(METXBIODB02462) 0.290(DBMET00509 )
Movement disorders treatment	0.558(DB00697;­METXBIODB02082) 0.409(METXBIODB02657) 0.373(DB00537)	0.352(DBMET00341;­METXBIODB00824) 0.334(CHEMBL3542349) 0.329(DB12148 )
Toxic, respiratory center	0.965(CHEMBL651;­DB00333;­METXBIODB02006) 0.902(DB00295;­METXBIODB00642) 0.889(DB00318;­METXBIODB00641)	0.902(DBMET00313;­METXBIODB00800) 0.892(DBMET00649) 0.885(DBMET00427;­DBMET02514 )
Proliferative diseases treatment	0.991(DB06287) 0.983(CHEMBL413;­DB00877;­METXBIODB01375) 0.976(METXBIODB00817)	0.990(DBMET00609) 0.986(METXBIODB02720) 0.984(CHEMBL3544688;­DBMET01749;­DBMET01753;­METXBIODB01377;­METXBIODB01381;­METXBIODB02763 )
DNA damaging	0.966(DB01181;­METXBIODB00963) 0.956(METXBIODB03049) 0.955(DB05109)	0.957(CHEMBL731;­DBMET00019) 0.956(DBMET00024;­METXBIODB00966) 0.951(DBMET01136 )
Phospholipase D inhibitor	0.197(DB01184) 0.188(METXBIODB01183) 0.178(METXBIODB00747)	0.194(DBMET00364;­METXBIODB00749) 0.190(METXBIODB01184) 0.163(METXBIODB03035 )
Neurotrophic factor	0.687(METXBIODB02965;­METXBIODB03088) 0.618(METXBIODB00323;­METXBIODB01252) 0.587(METXBIODB00199)	0.745(DBMET00094;­METXBIODB01465) 0.742(METXBIODB00859) 0.618(DBMET01736 )
Nitric-oxide synthase stimulant	0.991(DB00778;­METXBIODB01286) 0.943(CHEMBL532;­DB00199) 0.931(CHEMBL1741;­DB01211;­METXBIODB00619)	0.984(METXBIODB01287) 0.976(DBMET00944) 0.973(DBMET00828 )
Paget's disease treatment	0.851(DB00169) 0.839(CHEMBL846;­DB00136) 0.712(DB00153;­METXBIODB01575;­METXBIODB02762)	0.865(CHEMBL3544529;­DBMET00575) 0.830(CHEMBL3351075;­CHEMBL3542403) 0.809(DBMET02435 )
5 Hydroxytryptamine 3E antagonist	0.481(METXBIODB01089) 0.478(METXBIODB00010) 0.472(DB00918)	0.546(DBMET01362) 0.461(DBMET01361;­METXBIODB01090) 0.458(METXBIODB00011 )
Triose-phosphate isomerase inhibitor	0.804(DB00581) 0.795(DB01914;­DB09419;­DB11735) 0.695(DB00742;­DB11195)	0.945(DBMET01478) 0.764(DBMET02089) 0.710(DB04272 )
Antihyperlipoproteinemic	0.977(DB00175) 0.975(CHEMBL503;­DB00227;­METXBIODB01008) 0.932(CHEMBL1064;­DB00641;­METXBIODB01371)	0.977(DBMET02472) 0.972(CHEMBL1201373) 0.962(DBMET01699 )
Lanosterol 14 alpha demethylase inhibitor	0.989(CHEMBL64391;­DB01167;­METXBIODB00524) 0.952(DB00582) 0.942(DB01026)	0.989(CHEMBL4525087;­CHEMBL4525088) 0.988(DBMET00374;­METXBIODB00525) 0.978(METXBIODB00526 )
UGT2B9 substrate	0.971(DB00921) 0.955(METXBIODB01912) 0.930(DB04630)	0.955(DBMET00174) 0.910(DBMET03370) 0.896(DBMET00760 )
Narcotic antagonist	0.981(DB00921) 0.911(DB06230) 0.901(METXBIODB03062)	0.992(DBMET00176) 0.985(DBMET01858;­DBMET03369;­METXBIODB03063) 0.867(DBMET03370 )
Sphingosine kinase inhibitor	0.503(DB08868) 0.237(METXBIODB02270) 0.229(DB09494;­METXBIODB02529;­METXBIODB02655)	0.413(CHEMBL80254) 0.391(DBMET03096) 0.312(METXBIODB02656 )
SULT1A2 substrate	0.930(METXBIODB03110) 0.898(METXBIODB01202) 0.882(METXBIODB03128)	0.973(DBMET02101) 0.963(DBMET01312;­METXBIODB02868) 0.959(CHEMBL1208633;­METXBIODB02254 )
Respiratory analeptic	0.996(CHEMBL428647;­DB01229) 0.995(CHEMBL250785) 0.994(METXBIODB01048;­METXBIODB01414)	0.996(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.995(CHEMBL3526207;­DB06409;­DBMET03369;­METXBIODB02826) 0.994(CHEMBL3706543;­CHEMBL3706544;­CHEMBL517341;­DBMET00660;­DBMET01759;­DBMET02904;­METXBIODB01416;­METXBIODB02727;­METXBIODB02827 )
Antiviral (Ebola)	0.962(DB14761) 0.886(DB15661) 0.776(DB08934)	0.860(DB15660) 0.796(DB15686) 0.620(METXBIODB02223 )
Glutamate (mGluR6) antagonist	0.467(CHEMBL109;­DB00313;­METXBIODB01559) 0.382(DB00130) 0.369(DB00129)	0.743(DB00142) 0.541(CHEMBL3706509;­DBMET01109) 0.540(CHEMBL3544524 )
Antihistaminic	0.990(DB00501) 0.914(DB01084) 0.882(DB00863;­METXBIODB01235)	0.990(DBMET03242;­DBMET03243) 0.832(DBMET02354) 0.790(DBMET00959 )
Cathepsin L inhibitor	0.947(DB06670) 0.665(DB05521) 0.260(DB00188)	0.967(DBMET01475) 0.880(DBMET01472) 0.483(CHEMBL3526373 )
Aminopeptidase B inhibitor	0.712(CHEMBL1430) 0.624(DB01197) 0.581(DB00129)	0.753(DBMET00502) 0.690(DBMET00503) 0.687(DBMET00506 )
Acyl-CoA dehydrogenase inhibitor	0.380(DB00640) 0.294(DB09357;­DB11204) 0.283(DB11936)	0.901(DB03699) 0.879(DB02912;­DBMET03176) 0.783(DBMET03175 )
Actinic keratosis treatment	0.834(CHEMBL428647;­DB01229) 0.731(METXBIODB01414) 0.698(CHEMBL92;­DB01248)	0.820(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.712(METXBIODB01416) 0.698(DBMET00633 )
Histamine H2 receptor agonist	0.638(DB00501) 0.322(DB00585) 0.261(DB00863;­METXBIODB01235)	0.638(DBMET03242;­DBMET03243) 0.601(CHEMBL901) 0.286(DBMET00959 )
Fatty acid synthase inhibitor	0.635(METXBIODB02133) 0.493(METXBIODB02136) 0.431(METXBIODB02879)	0.426(METXBIODB02134) 0.356(METXBIODB02135) 0.337(DBMET00251;­METXBIODB00869 )
Cytokine production stimulant	0.254(DB14126) 0.136(METXBIODB00221) 0.127(DB09494;­METXBIODB02529)	0.277(DBMET01173;­METXBIODB01188) 0.254(DBMET01425) 0.206(DBMET00509 )
Antiviral (Herpesvirus 3, Human)	0.982(DB12151) 0.652(DB00718) 0.619(DB00441)	0.888(DBMET03374) 0.885(DBMET03375) 0.709(DB00369 )
Prostaglandin D2 agonist	0.624(DB01240) 0.538(DB00770) 0.470(DB00287)	0.613(DB00917) 0.610(DBMET02588) 0.538(DBMET02086 )
Insulin sensitizer	0.991(DB08822) 0.946(DB09198) 0.919(DB01132)	0.979(DBMET01305) 0.972(DBMET01301) 0.965(DBMET01517 )
Cystathionine beta-synthase inhibitor	0.960(METXBIODB03141) 0.949(METXBIODB02879) 0.946(METXBIODB01399)	0.946(METXBIODB02880) 0.942(METXBIODB03033) 0.932(METXBIODB02508 )
Antidote, organophosphates	0.406(DB00424) 0.219(DB00245) 0.189(METXBIODB00446)	0.406(DBMET03252;­DBMET03253) 0.189(CHEMBL3542326;­DBMET02633) 0.181(DBMET02632 )
Glutamate (mGluR3) antagonist	0.351(DB13848) 0.337(CHEMBL109;­DB00313;­METXBIODB01559) 0.331(DB00130)	0.370(CHEMBL3544524) 0.347(DB00142) 0.328(DB00123 )
Immunoglobulin Fc receptor antagonist	0.127(DB02546) 0.117(DB01577;­METXBIODB01797) 0.102(DB00182;­DB01576;­METXBIODB01904)	0.117(DB09571;­DBMET00634;­DBMET02228) 0.110(METXBIODB01762) 0.104(CHEMBL3544671;­DBMET02537 )
Delayed rectifier potassium channel blocker	0.585(METXBIODB02111) 0.123(METXBIODB02595) 0.104(DB00829)	0.329(METXBIODB02112) 0.264(METXBIODB02113) 0.120(CHEMBL3526841 )
Nicotinic acid receptor 2 antagonist	0.136(METXBIODB02370) 0.109(METXBIODB02368) 0.094(DB03793;­METXBIODB02476)	0.139(DB00312) 0.106(CHEMBL1222314) 0.094(DBMET01437 )
Anesthetic inhalation	0.970(DB00228;­METXBIODB00116) 0.958(DB01189) 0.942(DB01236)	0.699(DBMET02381;­DBMET02382;­DBMET02832;­DBMET02833;­DBMET02834) 0.693(DBMET01560;­METXBIODB00117) 0.666(DBMET00862 )
Anesthetic local	0.880(DB09085) 0.849(DB00721) 0.823(DB00866;­DB00907;­METXBIODB00058)	0.925(DBMET00645) 0.821(DBMET00386;­METXBIODB01304) 0.790(DBMET01394 )
Angiotensin AT1 receptor antagonist	0.988(DB00678;­METXBIODB01004;­METXBIODB01006) 0.981(CHEMBL191) 0.895(DB01029;­METXBIODB00929)	0.995(CHEMBL907;­METXBIODB01005) 0.993(DBMET00303) 0.988(CHEMBL308493 )
Acid ceramidase inhibitor	0.055(METXBIODB00891) 0.050(METXBIODB02655) 0.048(CHEMBL185)	0.052(METXBIODB01640) 0.048(DB00544;­DBMET00449;­DBMET03527) 0.047(DBMET01195;­METXBIODB00605 )
Argininosuccinate synthase inhibitor	0.777(DB00640) 0.550(DB00118) 0.518(DB01262)	0.968(DB00171) 0.944(DBMET00485;­DBMET03265) 0.904(DBMET00677 )
Histamine antagonist	0.989(DB00501) 0.911(DB01084) 0.879(DB00863;­METXBIODB01235)	0.989(DBMET03242;­DBMET03243) 0.828(DBMET02354) 0.787(DBMET00959 )
Antineoplastic (pancreatic cancer)	0.971(DB12473) 0.966(DB06176) 0.940(METXBIODB01643)	0.941(CHEMBL525;­DBMET01147) 0.923(CHEMBL3706540;­DBMET01123) 0.919(CHEMBL1593;­DBMET00658 )
UGT2B15 substrate	0.983(DB04630) 0.978(DB00741;­METXBIODB01729) 0.975(DB00687)	0.983(DBMET00372;­METXBIODB01730) 0.981(DBMET02846) 0.972(DBMET02851;­DBMET02853;­DBMET02863;­DBMET02864 )
Superoxide dismutase inhibitor	0.930(CHEMBL1430) 0.816(DB00129) 0.800(METXBIODB02168)	0.917(DBMET00502) 0.848(METXBIODB02504) 0.818(DB00123 )
Sphingosine 1-phosphate receptor 2 agonist	0.723(DB12612) 0.673(DB08868) 0.357(DB05016)	0.910(DBMET03096) 0.638(METXBIODB00593) 0.480(DBMET01478 )
Membrane dipeptidase inhibitor	0.740(DB06211) 0.263(DB00303) 0.187(DB06151)	0.218(CHEMBL3706517) 0.205(DBMET02123) 0.181(CHEMBL3706515;­CHEMBL3706516 )
Lipase inhibitor	0.335(METXBIODB01756) 0.276(METXBIODB02136) 0.270(METXBIODB02133)	0.409(DBMET03543) 0.386(CHEMBL3706470) 0.320(METXBIODB01757 )
Antimycoplasmal	0.984(METXBIODB01048) 0.975(CHEMBL532;­DB00199) 0.968(CHEMBL1741;­DB01211;­METXBIODB00619)	0.950(METXBIODB01049) 0.920(CHEMBL2063468;­DBMET01656) 0.905(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
Gaucher disease treatment	0.741(DB09039) 0.641(CHEMBL3527223) 0.246(METXBIODB00379)	0.638(CHEMBL80254) 0.497(DBMET03455) 0.468(DBMET03450;­DBMET03451;­DBMET03454 )
MDM2 inhibitor	0.145(METXBIODB02370) 0.134(METXBIODB02368) 0.120(METXBIODB01859)	0.175(DBMET01117) 0.139(DBMET01116) 0.127(CHEMBL3544833 )
Adenosine A3 receptor antagonist	0.759(DB00640) 0.737(DB00242) 0.643(DB01280)	0.824(CHEMBL3526900) 0.656(DBMET00496) 0.610(DBMET01160 )
Antihelmintic	0.943(DB11431) 0.818(METXBIODB00942) 0.779(METXBIODB01048)	0.985(DBMET03414) 0.978(DBMET03415) 0.944(DBMET02119 )
VEGF expression inhibitor	0.944(CHEMBL1504) 0.611(DB05294) 0.528(METXBIODB02986;­METXBIODB03010)	0.885(CHEMBL3542217) 0.873(CHEMBL3542337) 0.855(CHEMBL3542299 )
12-Lipoxygenase inhibitor	0.896(METXBIODB01398;­METXBIODB03058) 0.879(METXBIODB02879) 0.877(METXBIODB02194)	0.888(DBMET00251;­METXBIODB00869) 0.884(CHEMBL75589) 0.865(CHEMBL74898 )
Tocolytic	0.983(DB09059) 0.293(DB00378;­DB00816) 0.280(DB00871)	0.401(DBMET00840) 0.280(DBMET03275;­DBMET03276) 0.278(DBMET02067 )
SULT2A1 substrate	0.770(DB00279;­METXBIODB02434) 0.735(DB00451;­DB00509;­METXBIODB02811) 0.656(CHEMBL691;­DB00977;­METXBIODB01784)	0.924(CHEMBL1614648) 0.903(DBMET00559) 0.896(DBMET00555 )
Antiinfertility, female	0.953(METXBIODB02070) 0.901(CHEMBL83;­DB00675;­METXBIODB01400) 0.897(DB00539)	0.953(DBMET00032) 0.944(CHEMBL50995;­DBMET02716) 0.821(CHEMBL2137046;­DBMET00030;­METXBIODB01402 )
Lysophosphatidic acid 3 receptor antagonist	0.268(DB11677) 0.211(METXBIODB01129) 0.195(DB08887;­METXBIODB00762)	0.195(DBMET00546;­METXBIODB00763) 0.194(DB00154) 0.191(CHEMBL3544766 )
Endocannabinoid uptake inhibitor	0.332(METXBIODB02515) 0.300(DB11677) 0.293(METXBIODB02270)	0.395(DBMET01593;­DBMET01606;­DBMET02087;­METXBIODB00407;­METXBIODB00420) 0.333(DBMET01601;­METXBIODB00415) 0.294(DBMET01607;­DBMET01608;­DBMET01609;­DBMET01610;­METXBIODB00421;­METXBIODB00422;­METXBIODB00423;­METXBIODB00424 )
CYP2D6 substrate	0.996(CHEMBL269732;­DB00864;­METXBIODB00828;­METXBIODB00831) 0.992(METXBIODB01048) 0.977(DB00390;­METXBIODB00798)	0.997(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.996(CHEMBL3544602;­CHEMBL3544693;­CHEMBL3544709;­CHEMBL3544837;­CHEMBL3544838;­DBMET00390;­METXBIODB00832) 0.988(METXBIODB01049 )
UGT1A1 substrate	0.985(DB00921) 0.970(METXBIODB01912) 0.959(DB01183)	0.995(DBMET00176) 0.991(METXBIODB02676) 0.989(DBMET03369 )
Sphingosine 1-phosphate receptor 3 antagonist	0.331(DB08868) 0.267(DB12371) 0.206(DB06716)	0.850(DBMET03096) 0.207(METXBIODB00593) 0.204(METXBIODB00722 )
Antiviral (Rhinovirus)	0.213(METXBIODB00458) 0.206(DB01022) 0.204(DB01086)	0.241(CHEMBL3988903) 0.210(CHEMBL3544766) 0.188(DB12148;­DBMET01630;­METXBIODB00604 )
UGT1A3 substrate	0.990(DB00921) 0.987(METXBIODB01912) 0.981(DB01183)	0.987(DBMET00174) 0.968(DBMET00321;­METXBIODB01140) 0.967(METXBIODB01981 )
Radioprotector	0.910(CHEMBL3527416) 0.885(METXBIODB03141) 0.879(DB11296)	0.994(CHEMBL3988904) 0.991(CHEMBL3526780) 0.974(DBMET01883 )
Leukotriene C antagonist	0.924(CHEMBL787;­DB00471) 0.193(METXBIODB02380) 0.155(DB01241;­METXBIODB03090)	0.937(CHEMBL3526239) 0.849(CHEMBL3526481;­DBMET01248;­DBMET01249;­DBMET01709) 0.844(CHEMBL3526240 )
Pregnane X receptor antagonist	0.133(DB01536;­METXBIODB00393) 0.128(DB01024;­METXBIODB01063) 0.124(DB00624;­METXBIODB02276)	0.141(DBMET03366) 0.134(DBMET03211) 0.130(DBMET01766;­DBMET01767 )
15-Lipoxygenase inhibitor	0.882(METXBIODB02879) 0.872(METXBIODB01398;­METXBIODB03058) 0.865(METXBIODB01399)	0.880(DBMET00251;­METXBIODB00869) 0.871(CHEMBL446290) 0.862(CHEMBL75589 )
Sphingosine kinase 1 inhibitor	0.446(DB08868) 0.191(METXBIODB02270) 0.186(DB09494;­METXBIODB02529)	0.400(CHEMBL80254) 0.356(DBMET03096) 0.224(DBMET02693 )
UGT1A6 substrate	0.994(DB00390) 0.989(METXBIODB00730) 0.974(DB00783;­METXBIODB01814)	0.994(DBMET02502;­METXBIODB00731) 0.979(DBMET01658;­METXBIODB00779) 0.978(DBMET03007 )
Antidiabetic (type 2)	0.972(CHEMBL385517;­DB06335) 0.952(DB04876) 0.924(DB01261)	0.968(CHEMBL3350936;­DBMET00459) 0.939(DB09401) 0.929(CHEMBL3542418 )
Histone deacetylase SIRT3 inhibitor	0.154(CHEMBL1140) 0.147(DB01255) 0.119(DB00339)	0.167(DBMET01063) 0.154(DBMET02629) 0.147(DBMET02067 )
Kainate receptor agonist	0.264(METXBIODB02453) 0.219(CHEMBL109;­DB00313;­DB01235;­METXBIODB01559) 0.200(DB00130)	0.395(CHEMBL1367;­DBMET00060;­METXBIODB01563) 0.267(CHEMBL3706503;­DBMET00066;­DBMET00067) 0.264(CHEMBL116111;­CHEMBL3706507;­DB00142;­DBMET01106 )
Phosphodiesterase 1A inhibitor	0.929(DB00203) 0.697(DB00862) 0.625(METXBIODB00471)	0.671(DBMET03640) 0.668(DBMET00182) 0.564(DBMET00421;­METXBIODB01331 )
Hepatic disorders treatment	0.907(DB13853) 0.865(METXBIODB02278) 0.861(DB01586;­METXBIODB00939)	0.931(DBMET02057) 0.865(METXBIODB00941) 0.863(CHEMBL3706475 )
Cyclophilin D inhibitor	0.985(METXBIODB01947) 0.984(DB01132) 0.978(CHEMBL1770248;­DB11827)	0.992(DBMET01300) 0.991(DBMET01365) 0.985(DBMET00942 )
Antidiabetic	0.985(METXBIODB01947) 0.984(DB01132) 0.978(CHEMBL1770248;­DB11827)	0.992(DBMET01300) 0.991(DBMET01365) 0.985(DBMET00942 )
Proteasome inhibitor	0.836(DB00188) 0.280(DB05521) 0.277(DB06218)	0.455(DBMET01081) 0.358(CHEMBL3526373) 0.341(CHEMBL3544766 )
Vanilloid 2 agonist	0.097(DB08921;­DB11217;­DB11365;­METXBIODB00055) 0.084(DB00470) 0.080(METXBIODB02655)	0.129(METXBIODB02802) 0.117(METXBIODB03030) 0.111(METXBIODB02714 )
GABA B receptor agonist	0.590(DB00181) 0.366(CHEMBL1046;­DB00513) 0.292(METXBIODB02458)	0.365(CHEMBL3544571;­DBMET00855;­DBMET02006;­DBMET03583) 0.309(DB01440) 0.290(DB03704 )
Angiotensin II receptor antagonist	0.984(DB00678;­METXBIODB01004;­METXBIODB01006) 0.976(CHEMBL191) 0.935(DB00796)	0.992(CHEMBL907;­METXBIODB01005) 0.990(DBMET00303) 0.984(CHEMBL308493 )
Aldosterone antagonist	0.975(CHEMBL1393;­DB00421) 0.964(DB00700) 0.923(DB01395)	0.947(CHEMBL3544705;­DBMET02483) 0.896(CHEMBL3638292) 0.822(DBMET01655 )
Nicotinic acid receptor 1 antagonist	0.075(METXBIODB02907) 0.061(METXBIODB03029) 0.060(CHEMBL898)	0.057(CHEMBL3544508;­DBMET00728) 0.053(CHEMBL424;­DBMET02419) 0.052(CHEMBL1461;­DBMET02420;­METXBIODB01302 )
Calcium-independent phospholipase A2 inhibitor	0.089(METXBIODB02304) 0.069(METXBIODB00891) 0.068(DB01240)	0.198(CHEMBL1398) 0.098(DBMET03078) 0.077(CHEMBL3544571;­DBMET00855;­DBMET02006;­DBMET03583 )
Sphingosine kinase 2 inhibitor	0.375(DB08868) 0.219(METXBIODB02655) 0.212(METXBIODB02270)	0.395(DBMET03096) 0.259(CHEMBL1710849;­DBMET01641) 0.231(CHEMBL3527068 )
Adenosine uptake inhibitor	0.307(CHEMBL628;­DB00806) 0.100(DB00201;­METXBIODB00486) 0.094(METXBIODB00046)	0.165(CHEMBL3544675;­DBMET03234) 0.100(DBMET00535) 0.073(DBMET03232 )
Antiparasitic	0.951(DB11431) 0.845(METXBIODB00942) 0.842(METXBIODB01833)	0.987(DBMET03414) 0.981(DBMET03415) 0.952(DBMET02120 )
Amidase inhibitor	0.188(DB04557;­DB13854;­METXBIODB00406;­METXBIODB01977) 0.186(CHEMBL6;­DB00328;­METXBIODB00921) 0.184(DB13783)	0.292(DBMET03492) 0.265(CHEMBL3526518) 0.260(CHEMBL3544600 )
Phosphodiesterase 6D inhibitor	0.867(DB00203) 0.753(DB00862) 0.700(DB00820)	0.721(DBMET00421;­METXBIODB01331) 0.700(DBMET03416) 0.682(DBMET00182 )
Phobic disorders treatment	0.882(DB00285;­METXBIODB00162) 0.716(DB00176) 0.682(METXBIODB01592)	0.716(DBMET00055;­METXBIODB00163) 0.625(METXBIODB00164) 0.618(DBMET02781;­DBMET03704 )
Estrogen-related receptor beta agonist	0.670(METXBIODB01404) 0.657(METXBIODB00268) 0.520(CHEMBL83;­DB00675;­METXBIODB01400)	0.657(CHEMBL2137046;­DBMET00030;­METXBIODB01402) 0.591(CHEMBL4525766;­METXBIODB00270) 0.442(METXBIODB01709 )
Melanin inhibitor	0.938(DB09298) 0.872(METXBIODB03141) 0.813(CHEMBL464825)	0.923(DBMET01841) 0.917(METXBIODB02188) 0.894(METXBIODB02189 )
Exportin-1 inhibitor	0.199(DB06799) 0.176(CHEMBL672;­DB01039) 0.174(METXBIODB00350)	0.201(DBMET03181) 0.169(DBMET03180) 0.164(DBMET01591 )
Nicotinic alpha3beta2 receptor antagonist	0.985(METXBIODB01541) 0.651(DB01156;­METXBIODB00109;­METXBIODB01854) 0.416(METXBIODB01741)	0.975(METXBIODB01542) 0.903(DBMET03469;­DBMET03471) 0.467(METXBIODB00113;­METXBIODB01858 )
Hedgehog signaling activator	0.284(METXBIODB01504) 0.186(DB01586;­METXBIODB00939;­METXBIODB02278) 0.179(DB05812)	0.236(METXBIODB01981) 0.186(DB06777;­METXBIODB00941) 0.165(DBMET03598 )
Aconitate hydratase inhibitor	0.638(DB03793;­METXBIODB02476) 0.590(CHEMBL109;­DB00313;­METXBIODB01559) 0.477(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.890(DBMET03078) 0.861(DB04272) 0.818(DBMET01108 )
VCAM1 expression inhibitor	0.964(CHEMBL1064;­DB00641;­METXBIODB01371) 0.941(DB01234;­METXBIODB00696) 0.835(METXBIODB01748)	0.941(DB00443) 0.934(CHEMBL3544664) 0.928(DBMET01699 )
Antiviral (Enterovirus)	0.128(DB00737) 0.084(DB00557) 0.078(DB01097;­METXBIODB01809)	0.085(DBMET01193;­METXBIODB00603) 0.074(CHEMBL4525085) 0.073(DBMET02576;­METXBIODB01624 )
Antihemophilic	0.440(DB05016) 0.380(DB09059) 0.193(DB03088)	0.167(DBMET00494) 0.145(DBMET03379) 0.142(DBMET01535 )
Na+ K+ transporting ATPase inhibitor	0.932(DB00390) 0.914(METXBIODB00730) 0.593(CHEMBL250785)	0.932(DBMET02502;­METXBIODB00731) 0.917(DBMET02501) 0.793(DBMET03414 )
Prostaglandin F2 alpha agonist	0.944(DB00287) 0.926(DB08819) 0.522(DB00770)	0.762(DBMET02216) 0.718(DB00917) 0.674(DBMET00481 )
Melatonin receptor 1A agonist	0.676(DB01065) 0.297(METXBIODB01089) 0.215(METXBIODB01023)	0.264(DBMET00411) 0.212(METXBIODB00012) 0.204(DBMET01359 )
Granulocyte macrophage colony stimulating factor agonist	0.250(METXBIODB02513) 0.238(DB01086) 0.228(METXBIODB00233)	0.260(CHEMBL3542349) 0.248(METXBIODB02806) 0.240(DBMET00691;­DBMET02359 )
Muscular dystrophy treatment	0.964(CHEMBL160;­DB00091) 0.927(DB11921) 0.891(DB15566)	0.971(CHEMBL3544640) 0.964(CHEMBL3526346) 0.952(CHEMBL2407580;­CHEMBL3544638;­CHEMBL3544879;­DBMET00359 )
Protease 3C (Human rhinovirus) inhibitor	0.227(DB09292) 0.223(CHEMBL1233;­DB00395) 0.153(METXBIODB00458)	0.230(CHEMBL3988903) 0.218(CHEMBL3544766) 0.191(CHEMBL3526717 )
Lysophosphatidic acid receptor 1 agonist	0.236(DB11677) 0.139(METXBIODB01129) 0.130(DB13966)	0.152(DBMET03096) 0.125(DBMET01594;­DBMET01595;­DBMET01596;­METXBIODB00408;­METXBIODB00409;­METXBIODB00410) 0.124(METXBIODB01130 )
5 Hydroxytryptamine 3A agonist	0.678(DB00889;­METXBIODB00874) 0.411(METXBIODB00288) 0.383(CHEMBL2104993;­DB09068)	0.555(DBMET00406;­METXBIODB00876) 0.492(DBMET01778) 0.475(METXBIODB00875 )
Pregnane X receptor agonist	0.988(CHEMBL374478) 0.928(DB11753) 0.758(CHEMBL444633;­DB00615)	0.979(CHEMBL446290) 0.928(CHEMBL3323549) 0.890(DBMET02189 )
Alcohol dehydrogenase substrate	0.996(METXBIODB02531) 0.914(METXBIODB03135) 0.902(METXBIODB00323;­METXBIODB01252)	0.996(DB02325) 0.986(METXBIODB00859) 0.977(CHEMBL731;­DBMET00019 )
Cholesterol absorption inhibitor	0.483(CHEMBL1064;­CHEMBL503;­DB00227;­DB00641;­METXBIODB01008;­METXBIODB01371) 0.413(DB00175) 0.382(METXBIODB01748)	0.726(DBMET02118) 0.695(DBMET02115;­METXBIODB02286) 0.677(DBMET02475 )
Peptide deformylase inhibitor	0.114(DB01197) 0.099(DB02546) 0.084(DB06151)	0.104(CHEMBL3527294) 0.088(CHEMBL3544766) 0.083(DBMET01108 )
5 Hydroxytryptamine 4 antagonist	0.859(DB06480) 0.650(DB00604) 0.536(DB13345)	0.788(DBMET02197) 0.579(DBMET02198) 0.576(DBMET02203 )
Aldehyde dehydrogenase substrate	0.785(CHEMBL88;­DB00531;­METXBIODB00960) 0.756(METXBIODB03135) 0.742(METXBIODB00323;­METXBIODB01252)	0.940(CHEMBL731;­DBMET00019) 0.928(METXBIODB00859) 0.920(DBMET02013 )
Antiseptic	0.954(DB01294) 0.869(DB13960) 0.846(METXBIODB03031)	0.888(DBMET00809) 0.861(DBMET01394) 0.859(CHEMBL3544545 )
Sodium/glucose cotransporter 1 inhibitor	0.817(CHEMBL1770248;­DB11827) 0.746(DB12713) 0.704(DB06292)	0.824(CHEMBL3526185;­CHEMBL3527604;­DBMET01910;­DBMET01911) 0.753(DBMET01912) 0.704(DBMET01909 )
Glutathione S-transferase substrate	0.986(CHEMBL88;­DB00175;­DB00531;­METXBIODB00960) 0.983(METXBIODB01071) 0.981(METXBIODB02869)	0.991(CHEMBL3706541) 0.989(CHEMBL3706539;­METXBIODB01072) 0.986(DBMET01683;­DBMET02472 )
Glutamate (mGluR8) antagonist	0.125(DB06739;­METXBIODB00580;­METXBIODB03056) 0.123(CHEMBL109;­DB00313;­METXBIODB01559) 0.113(DB00129;­DB00130)	0.165(DBMET01507) 0.147(DB00142) 0.118(CHEMBL3706509;­DBMET01109 )
Prostaglandin agonist	0.921(DB01240) 0.893(DB08819) 0.881(DB00287)	0.905(DB00917) 0.821(DBMET02588) 0.817(DBMET00481 )
Hypercalcemia treatment	0.687(CHEMBL846;­DB00136) 0.574(DB06670) 0.568(DB00169)	0.628(CHEMBL3542380;­CHEMBL3542386) 0.627(DBMET02435) 0.621(CHEMBL3544529;­DBMET00575 )
Prostaglandin EP2 agonist	0.689(DB00770) 0.626(DB00287) 0.597(DB00929)	0.824(DB00917) 0.705(DBMET02637) 0.689(DBMET02086 )
Ca(v)3.1 blocker	0.591(DB13853) 0.383(METXBIODB03053) 0.377(METXBIODB02470)	0.622(DBMET02057) 0.333(CHEMBL117487;­CHEMBL3706510;­DBMET00065) 0.293(DB12148 )
Aldehyde dehydrogenase inhibitor	0.826(METXBIODB00925) 0.810(METXBIODB00855) 0.788(DB01645;­METXBIODB00465)	0.964(DB00171) 0.939(DBMET00485;­DBMET03265) 0.903(METXBIODB00928 )
Glucose-6-phosphate isomerase inhibitor	0.473(DB00581) 0.442(DB01914;­DB09419;­DB11735) 0.319(DB00742;­DB11195)	0.847(DBMET01478) 0.512(DBMET02088) 0.396(DB03947 )
UDP-glucose 4-epimerase inhibitor	0.653(DB09144) 0.632(DB00581) 0.629(DB00432)	0.965(DB01861;­DB03501) 0.740(CHEMBL1774;­DBMET02000;­DBMET03590) 0.736(DB00171 )
Cardiodepressant	0.992(CHEMBL1512) 0.987(DB00866) 0.984(CHEMBL633;­DB01118)	0.987(CHEMBL3542209;­DBMET00740) 0.984(CHEMBL4525130;­CHEMBL4525131;­CHEMBL4525132;­CHEMBL4525133;­CHEMBL4525134;­CHEMBL4525135;­CHEMBL4525136;­CHEMBL4525137;­CHEMBL4525138) 0.983(CHEMBL4525792 )
Glutamate (mGluR7) agonist	0.266(METXBIODB01417) 0.263(METXBIODB00039) 0.202(DB06218)	0.416(CHEMBL3706469) 0.257(DB00142) 0.228(DBMET01652 )
Antismoking	0.866(DB00273) 0.812(CHEMBL3;­DB00184;­METXBIODB02230) 0.804(CHEMBL52440;­DB00514;­METXBIODB00707)	0.828(DBMET03469;­DBMET03471) 0.801(CHEMBL1254766;­DB14682;­METXBIODB00708) 0.792(CHEMBL6200;­DBMET00520 )
Acetylcholine M4 receptor antagonist	0.621(DB01062;­METXBIODB00150) 0.531(CHEMBL715;­DB00334;­METXBIODB01125) 0.477(DB01074;­METXBIODB00067)	0.706(CHEMBL440512;­METXBIODB01127) 0.506(DBMET01734;­DBMET01826;­METXBIODB01231;­METXBIODB01851) 0.398(METXBIODB01314 )
Histamine H1 receptor agonist	0.169(DB06698) 0.133(DB01620) 0.117(METXBIODB02408)	0.195(DBMET02635) 0.152(DBMET02636) 0.095(DBMET00377;­METXBIODB00149;­METXBIODB01001 )
Leukotriene C4 antagonist	0.923(CHEMBL787;­DB00471) 0.172(METXBIODB02380) 0.133(DB01241;­METXBIODB03090)	0.931(CHEMBL3526239) 0.850(CHEMBL3526481;­DBMET01248;­DBMET01249;­DBMET01709) 0.844(CHEMBL3526240 )
Free fatty acid receptor 1 antagonist	0.131(DB00573) 0.130(METXBIODB00301) 0.123(DB06819)	0.161(DBMET00510) 0.128(DBMET00869;­METXBIODB03151) 0.120(DBMET00808 )
Cathepsin G inhibitor	0.732(DB09059) 0.631(DB06176) 0.471(DB00188)	0.481(CHEMBL3526373) 0.470(CHEMBL3544766) 0.462(CHEMBL3544779 )
Purinergic P2Y15 antagonist	0.181(DB00640) 0.088(DB00118) 0.075(DB00242)	0.113(DBMET00485;­DBMET03265) 0.094(DBMET00514) 0.090(DB00171 )
Antihelmintic (Nematodes)	0.899(DB11431) 0.635(METXBIODB01151) 0.596(DB00518)	0.996(DBMET03414;­DBMET03415) 0.925(DBMET02119) 0.703(DBMET02120 )
Glucosylceramidase stimulant	0.043(DB12911;­METXBIODB01812) 0.041(METXBIODB00891) 0.039(METXBIODB01220)	0.041(METXBIODB01813) 0.040(CHEMBL3526371) 0.038(DBMET02629 )
Porphobilinogen synthase inhibitor	0.836(METXBIODB01209) 0.831(DB11145) 0.821(METXBIODB01301)	0.865(DBMET01974) 0.829(CHEMBL3542351) 0.821(CHEMBL424;­DBMET02419 )
Glutamate (mGluR group III) antagonist	0.339(METXBIODB02368) 0.297(METXBIODB02370) 0.256(DB00627)	0.398(CHEMBL3544524) 0.318(DB00142) 0.205(DB00123 )
Corneal wound healing stimulator	0.563(METXBIODB02515) 0.503(DB02546) 0.481(DB08908)	0.674(DB01677) 0.548(DB14219) 0.540(DBMET01593;­DBMET01606;­DBMET02087;­METXBIODB00407;­METXBIODB00420 )
Enoyl-[acyl-carrier-protein] reductase inhibitor	0.328(METXBIODB02615) 0.294(DB00737) 0.222(METXBIODB02655)	0.459(DBMET02576) 0.299(CHEMBL446290) 0.286(DBMET01194;­DBMET01196;­METXBIODB00601;­METXBIODB00602 )
Cannabinoid CB2 receptor antagonist	0.892(DB00470) 0.827(METXBIODB00199) 0.399(METXBIODB00070)	0.868(DBMET00120;­DBMET01785) 0.743(METXBIODB00200) 0.686(DBMET01221 )
3C-Like protease (SARS coronavirus) inhibitor	0.206(DB08908) 0.178(DB01914;­DB09419;­DB11735) 0.176(DB00188)	0.457(METXBIODB00859) 0.392(DBMET03077) 0.352(DB03947 )
Aminopeptidase I inhibitor	0.356(DB06151) 0.337(CHEMBL1314;­DB06823) 0.321(DB00230)	0.416(DBMET00503) 0.387(CHEMBL3527294) 0.366(DBMET00508 )
Thromboxane A2 agonist	0.291(DB00770) 0.113(DB01240) 0.097(METXBIODB02515)	0.330(DB00917) 0.291(DBMET02086) 0.220(DBMET02588 )
ATP citrate lysase inhibitor	0.365(DB11936) 0.257(METXBIODB02697) 0.221(METXBIODB02172)	0.263(DB04272) 0.215(DBMET03614) 0.209(DBMET01600;­METXBIODB00414 )
Catalase inhibitor	0.507(DB06151) 0.503(DB00126) 0.459(DB00130)	0.546(DBMET00503) 0.512(DBMET00799) 0.508(DBMET00508 )
Angiotensin AT1A receptor antagonist	0.958(METXBIODB01006) 0.953(DB00678;­METXBIODB01004) 0.881(DB01029;­METXBIODB00929)	0.958(CHEMBL308493) 0.936(CHEMBL907;­METXBIODB01005) 0.791(DBMET01053;­METXBIODB00932 )
Transcription factor NF kappa B inhibitor	0.991(DB00778;­METXBIODB01286) 0.987(CHEMBL532;­DB00199) 0.981(CHEMBL1741;­DB01211;­METXBIODB00619)	0.990(METXBIODB01287) 0.986(CHEMBL2063468;­CHEMBL3542282;­CHEMBL3542283;­DBMET01656) 0.983(CHEMBL3542263 )
Chemopreventive	0.989(CHEMBL3542194) 0.987(CHEMBL1783834) 0.984(DB13751)	0.989(CHEMBL4525142;­CHEMBL4525143) 0.988(CHEMBL3542278;­CHEMBL3542372) 0.987(CHEMBL3542263 )
Neuraminidase (Influenza B) inhibitor	0.367(DB00198) 0.052(DB03088) 0.047(DB03793;­METXBIODB02476)	0.709(DBMET02218) 0.102(DBMET03118) 0.070(DBMET03290 )
Antineoplastic antimetabolite	0.956(DB00631) 0.930(DB00242) 0.913(DB00441)	0.992(DBMET00677) 0.991(DBMET01155;­DBMET01157) 0.990(DBMET00419 )
Oxytocin agonist	0.149(DB09059) 0.064(DB01255;­METXBIODB03110) 0.060(METXBIODB01512)	0.085(CHEMBL3526373) 0.078(CHEMBL3527294) 0.076(DBMET02067 )
Neuropeptide Y1 antagonist	0.346(METXBIODB00247) 0.322(DB01023;­METXBIODB00100) 0.303(METXBIODB00020)	0.344(DBMET03491) 0.315(DBMET00368;­METXBIODB00101) 0.314(DBMET03492 )
Genotoxic	0.993(DB00773;­METXBIODB00808) 0.987(METXBIODB01256) 0.980(METXBIODB02869)	0.994(DBMET00367;­DBMET00853;­DBMET01264;­METXBIODB00809;­METXBIODB01257) 0.991(DBMET01265) 0.990(METXBIODB01362 )
UGT1A4 substrate	0.969(METXBIODB01980) 0.966(METXBIODB02993) 0.963(METXBIODB00249)	0.974(METXBIODB01981) 0.972(DBMET03599) 0.971(METXBIODB00940 )
Antidote	0.954(CHEMBL269732;­DB00864;­METXBIODB00828) 0.888(METXBIODB00831) 0.886(CHEMBL3527416)	0.994(CHEMBL3988904) 0.942(CHEMBL3544693;­DBMET00390) 0.937(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830 )
Melanocortin 1 antagonist	0.179(DB09059) 0.165(DB11296) 0.121(DB01255)	0.145(DBMET02067) 0.136(DBMET00840) 0.111(CHEMBL3526373 )
Skin irritative effect	0.995(CHEMBL1473;­DB00588) 0.993(CHEMBL1370;­DB01222;­METXBIODB01745) 0.990(CHEMBL1504;­DB06781;­METXBIODB01928;­METXBIODB02965;­METXBIODB03088)	0.994(METXBIODB02066) 0.993(CHEMBL3542373;­CHEMBL3542395;­DBMET00476;­DBMET02914;­METXBIODB01746) 0.991(METXBIODB02569 )
Phosphofructokinase-1 inhibitor	0.870(DB00640) 0.754(DB00581) 0.628(DB01914;­DB09419;­DB11735)	0.977(DB03699) 0.974(DB00171) 0.971(DB04045 )
Kainate receptor 2 antagonist	0.265(CHEMBL109;­DB00313;­METXBIODB01559) 0.195(DB00129) 0.177(DB00268)	0.489(CHEMBL1367;­DBMET00060;­METXBIODB01563) 0.301(CHEMBL3706503;­DBMET00066;­DBMET00067) 0.294(DBMET02986 )
3(or 17)beta-hydroxysteroid dehydrogenase inhibitor	0.552(DB00655;­METXBIODB02494) 0.479(METXBIODB00781) 0.469(DB00783;­METXBIODB01814)	0.552(DBMET00490) 0.479(DBMET00248;­DBMET01659) 0.469(DBMET00491;­METXBIODB00083 )
Acetylcholine M4 receptor agonist	0.486(DB00185;­METXBIODB00507) 0.377(DB01591) 0.318(DB01184)	0.486(DBMET00430;­DBMET00431;­DBMET00433) 0.236(DBMET00746) 0.200(METXBIODB01386 )
Prolyl endopeptidase inhibitor	0.225(DB00178;­DB00519) 0.207(DB00584) 0.200(DB00881)	0.244(DBMET00995;­DBMET01014) 0.224(DBMET01269) 0.216(DBMET01141 )
Acetylcholine M1 receptor antagonist	0.814(DB00185;­METXBIODB00507) 0.809(METXBIODB01623) 0.782(DB01062;­METXBIODB00150)	0.814(DBMET00430;­DBMET00431;­DBMET00433) 0.737(DBMET00645) 0.724(DBMET00746 )
Calcium channel P-type blocker	0.267(DB00737) 0.182(DB00874) 0.169(METXBIODB00531)	0.215(DBMET02576) 0.182(DBMET02245) 0.176(DBMET02577 )
Glucosylceramidase inhibitor	0.337(CHEMBL3527223) 0.213(DB01914;­DB09419;­DB11735) 0.199(METXBIODB00379)	0.649(CHEMBL80254) 0.350(CHEMBL3526603) 0.201(DBMET02088 )
Dopamine D1 antagonist	0.995(DB13345) 0.984(METXBIODB00475) 0.972(DB06077)	0.924(DBMET03129) 0.897(DBMET03128) 0.895(DBMET01824 )
Thromboxane agonist	0.691(DB00770) 0.228(DB00287) 0.207(DB00654)	0.891(DB00917) 0.741(DBMET02588) 0.691(DBMET02086 )
Nicotinic acid receptor 2 agonist	0.259(DB03793;­METXBIODB02476) 0.210(DB00627) 0.193(METXBIODB02564)	0.446(DB14132) 0.342(CHEMBL3526166) 0.303(CHEMBL3544508;­DBMET00728;­DBMET00993 )
Cannabinoid CB1 receptor agonist	0.397(DB00470) 0.243(METXBIODB02270) 0.241(DB09084)	0.372(DBMET00120;­DBMET01785) 0.345(METXBIODB00200) 0.297(DBMET01221 )
AMPA 4 receptor antagonist	0.481(DB00129) 0.342(DB00130) 0.300(DB00177)	0.505(DB00123) 0.311(DB00142) 0.262(DBMET02986 )
NADPH oxidase inhibitor	0.731(METXBIODB01398;­METXBIODB03058) 0.725(METXBIODB02194) 0.717(METXBIODB02821)	0.741(METXBIODB03059) 0.726(METXBIODB02823) 0.720(CHEMBL75589 )
Alcohol dehydrogenase inhibitor	0.602(CHEMBL1430) 0.550(CHEMBL3527416) 0.525(CHEMBL898)	0.747(CHEMBL3638284) 0.719(DBMET00769) 0.717(CHEMBL1237125;­CHEMBL3638285;­DBMET00657 )
Prostaglandin E2 agonist	0.881(DB01240) 0.876(DB00287) 0.775(DB00770)	0.885(DB00917) 0.830(DBMET02588) 0.829(DBMET02216 )
Anesthetic	0.923(DB05087) 0.915(CHEMBL250785) 0.892(DB01062;­METXBIODB00150)	0.908(DBMET03442) 0.886(DBMET03598;­METXBIODB00336) 0.883(DBMET03212 )
Lysophosphatidic acid receptor 3 agonist	0.272(DB11677) 0.132(METXBIODB02270) 0.118(DB13966)	0.111(DBMET02072) 0.110(METXBIODB00722) 0.108(METXBIODB00593 )
Potassium channel (Tandem pore domain) blocker	0.153(DB01171) 0.120(DB04841) 0.119(DB01097;­METXBIODB01809)	0.153(DBMET02153) 0.149(DBMET01777) 0.128(METXBIODB01823 )
Carbonic anhydrase stimulant	0.586(DB11296) 0.525(DB00273) 0.482(DB01124)	0.492(DBMET01483) 0.471(DBMET02909;­DBMET02910) 0.380(CHEMBL3544766 )
Toll-Like receptor 4 agonist	0.197(DB03852;­METXBIODB00171) 0.082(DB09031) 0.056(DB00581)	0.342(DBMET02089) 0.266(METXBIODB00593) 0.130(DBMET00509 )
Farnesoid X receptor antagonist	0.962(CHEMBL104) 0.640(METXBIODB01504) 0.604(DB01241;­METXBIODB03090)	0.626(METXBIODB00250) 0.622(DBMET02786) 0.569(METXBIODB01505 )
Angiotensin AT2 receptor antagonist	0.985(METXBIODB01006) 0.984(DB00678;­METXBIODB01004) 0.804(CHEMBL191)	0.985(CHEMBL308493) 0.961(CHEMBL907;­METXBIODB01005) 0.804(CHEMBL4525128;­CHEMBL4525129 )
Thromboxane synthase inhibitor	0.739(METXBIODB00744) 0.649(METXBIODB00097) 0.496(METXBIODB01452)	0.510(CHEMBL3544626) 0.508(METXBIODB00746) 0.504(DBMET01879 )
Complement factor 1s inhibitor	0.063(DB00250) 0.044(METXBIODB01387) 0.043(METXBIODB01430;­METXBIODB02349;­METXBIODB03012)	0.043(DBMET00070;­DBMET01043;­DBMET03118) 0.042(CHEMBL1222314) 0.037(DBMET01162;­DBMET02964 )
Acetylcholine M5 receptor antagonist	0.366(DB01062;­METXBIODB00150) 0.351(DB00983) 0.325(DB00342;­METXBIODB00571)	0.376(DBMET02956) 0.315(DBMET01734;­DBMET01826;­METXBIODB01231;­METXBIODB01851) 0.307(CHEMBL440512;­METXBIODB01127 )
Adenosine deaminase inhibitor	0.983(DB00640) 0.972(DB00242) 0.815(DB01280)	0.981(DB00171) 0.967(DBMET00677) 0.966(DBMET00485;­DBMET03265 )
Death-associated protein kinase 1 inhibitor	0.538(DB06595) 0.449(METXBIODB03012) 0.376(DB00437)	0.467(DBMET01440) 0.449(DBMET01043) 0.446(DBMET01441 )
Glutamate (mGluR1) agonist	0.224(DB00130) 0.188(DB01235) 0.177(DB13848)	0.328(DBMET00486) 0.327(DB00142) 0.309(DBMET01324 )
Antiviral (Papilloma)	0.892(DB12151) 0.871(DB09299) 0.742(CHEMBL160;­DB00091)	0.874(DBMET03374) 0.848(DBMET03375) 0.839(DBMET03569 )
Radiosensitizer	0.981(CHEMBL92;­DB01248) 0.973(DB06772) 0.964(CHEMBL428647;­DB01229)	0.981(DBMET00633) 0.975(CHEMBL3706530;­DBMET01649) 0.974(DBMET00999 )
Lysophosphatidic acid 1 receptor antagonist	0.100(METXBIODB00762) 0.096(DB04557;­DB13854;­METXBIODB00406;­METXBIODB01977) 0.093(DB03756)	0.100(DBMET00546;­METXBIODB00763) 0.096(DB00154) 0.078(DBMET01594;­DBMET01595;­DBMET01596;­DBMET01599;­METXBIODB00408;­METXBIODB00409;­METXBIODB00410;­METXBIODB00413 )
Sphingosine 1-phosphate receptor antagonist	0.459(DB12371) 0.412(DB05016) 0.317(DB08868)	0.949(DBMET03096) 0.282(DBMET03312) 0.200(DBMET01341 )
Biliverdin reductase inhibitor	0.706(METXBIODB02273) 0.647(DB00640) 0.424(DB03793;­METXBIODB02476)	0.825(DB00171;­DBMET00485;­DBMET03265) 0.621(CHEMBL1237125;­DBMET00657;­DBMET00769) 0.601(DBMET01158;­DBMET02967 )
Apical sodium codependent bile acid transporter inhibitor	0.139(METXBIODB03034) 0.131(DB02659;­METXBIODB00251) 0.130(DB01586;­METXBIODB00939;­METXBIODB01504)	0.142(DBMET01434) 0.137(METXBIODB03035) 0.132(CHEMBL3186899;­DBMET01884 )
DNA synthesis inhibitor	0.954(DB00631) 0.937(DB00242) 0.932(DB00441)	0.995(CHEMBL3526610) 0.994(DBMET00677) 0.993(DBMET00859 )
Isoleucine-tRNA ligase inhibitor	0.513(DB00410) 0.129(DB00640) 0.101(DB00242)	0.098(DBMET00514) 0.093(DBMET00912) 0.058(DBMET01435 )
Cannabinoid receptor antagonist	0.686(DB00470) 0.629(CHEMBL2103817) 0.615(METXBIODB00199)	0.610(DBMET00120;­DBMET01785) 0.512(METXBIODB00200) 0.401(DBMET01221 )
5-Alpha-reductase inhibitor	0.897(CHEMBL710;­DB01216) 0.710(METXBIODB02993) 0.677(DB00603;­METXBIODB02099)	0.976(CHEMBL3542374) 0.875(CHEMBL4525755) 0.812(METXBIODB00940 )
Ornithine decarboxylase inhibitor	0.932(DB00799) 0.805(DB00755;­DB00982;­METXBIODB00937) 0.744(METXBIODB00323;­METXBIODB01252)	0.904(DBMET00454) 0.879(DBMET01005) 0.805(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253 )
5 Hydroxytryptamine 4 agonist	0.949(DB06480) 0.676(DB00604) 0.140(DB01233)	0.976(DBMET02201) 0.826(DBMET02197) 0.736(DBMET00355 )
S-adenosyl-L-methionine decarboxylase inhibitor	0.393(DB00640) 0.325(METXBIODB00880) 0.301(DB01438)	0.317(DB13410;­METXBIODB00881) 0.225(DBMET00514) 0.192(DBMET00485;­DBMET03265 )
Tourette's syndrome treatment	0.510(DB11915) 0.441(METXBIODB00923) 0.353(DB04844)	0.441(DBMET00323;­METXBIODB01276) 0.397(DBMET01447) 0.382(DBMET00458;­DBMET00800;­DBMET01448 )
mTOR complex 2 inhibitor	0.858(CHEMBL413;­DB00877;­METXBIODB01375) 0.850(METXBIODB00817) 0.825(DB06287)	0.858(DBMET00628;­METXBIODB00818) 0.855(CHEMBL3544651;­DBMET00389;­DBMET01748;­METXBIODB01376) 0.853(METXBIODB00819 )
Toll-Like receptor 8 agonist	0.089(CHEMBL585;­DB00384) 0.081(DB09494;­METXBIODB02529) 0.069(METXBIODB02461)	0.093(DBMET02122) 0.082(DBMET03096) 0.068(DBMET02072 )
GABA aminotransferase inhibitor	0.763(METXBIODB02368) 0.699(METXBIODB02370) 0.649(CHEMBL1046;­DB00513)	0.760(DBMET01955) 0.624(DB02362;­DBMET01429) 0.587(DBMET01108 )
Alcohol oxidase inhibitor	0.913(DB03793;­METXBIODB02476) 0.911(DB11145) 0.905(METXBIODB02513)	0.913(DBMET01437) 0.910(DBMET03076) 0.902(METXBIODB03149 )
Mental retardation treatment	0.448(CHEMBL661;­DB00404) 0.441(DB00897) 0.433(DB01215)	0.433(DBMET00632) 0.216(CHEMBL3246317;­DBMET00112) 0.210(DBMET00396 )
Alpha-mannosidase inhibitor	0.906(CHEMBL3527223) 0.603(DB11217) 0.548(DB01914;­DB09419;­DB11735)	0.847(DBMET02088) 0.801(DBMET00509) 0.744(CHEMBL80254 )
1-Deoxy-D-xylulose-5-phosphate reductoisomerase inhibitor	0.093(DB02546) 0.032(METXBIODB00189) 0.030(METXBIODB02729)	0.060(METXBIODB00349) 0.026(DBMET02228;­METXBIODB01143) 0.023(DB02083 )
Androgen antagonist	0.995(CHEMBL1473;­DB00588) 0.993(DB00687) 0.987(DB00959)	0.985(DB00443) 0.979(DBMET02900;­DBMET02901) 0.978(DBMET02920 )
Angiotensin AT1B receptor antagonist	0.980(DB00678;­METXBIODB01004) 0.961(METXBIODB01006) 0.876(DB01029;­METXBIODB00929)	0.993(CHEMBL907;­METXBIODB01005) 0.961(CHEMBL308493) 0.807(DBMET01053;­METXBIODB00932 )
Cannabinoid CB1 receptor antagonist	0.655(CHEMBL2103817) 0.592(DB00470) 0.550(METXBIODB00199)	0.532(DBMET00120;­DBMET01785) 0.452(CHEMBL3526890) 0.448(METXBIODB00200 )
Contraceptive female	0.985(DB00294) 0.984(METXBIODB00694;­METXBIODB01137) 0.963(DB00304;­METXBIODB00693)	0.984(DBMET00723;­DBMET00724;­DBMET01642;­DBMET01643;­METXBIODB00695) 0.969(DBMET01704) 0.900(METXBIODB01138 )
Macrophage migration inhibitory factor inhibitor	0.825(METXBIODB01731) 0.718(METXBIODB02959) 0.656(METXBIODB00854)	0.765(METXBIODB01732) 0.745(METXBIODB00242) 0.583(METXBIODB00926 )
3C-Like protease (MERS coronavirus) inhibitor	0.040(DB01247) 0.016(DB14187) 0.013(DB01914;­DB08908;­DB09419;­DB11735)	0.079(METXBIODB00859) 0.036(DBMET01630;­METXBIODB00604) 0.034(CHEMBL721;­DBMET01126 )
Benzodiazepine antagonist	0.591(DB00425) 0.388(DB00683;­METXBIODB01040) 0.364(CHEMBL512306)	0.301(DBMET01242) 0.297(DBMET01241) 0.243(DBMET01238 )
Histone deacetylase 9 inhibitor	0.790(CHEMBL483254) 0.767(DB06176) 0.528(DB02546)	0.605(CHEMBL3527527) 0.458(DBMET01443) 0.358(DBMET01414 )
Protease (Human cytomegalovirus) inhibitor	0.083(METXBIODB01812) 0.082(DB00865;­METXBIODB01761) 0.077(DB06218)	0.120(DBMET00965) 0.050(METXBIODB01762) 0.045(CHEMBL3544766;­DB09571;­DBMET00634;­DBMET01457 )
Carbamoyl phosphate synthetase inhibitor	0.772(DB00640) 0.705(DB00118) 0.566(DB00242)	0.937(DB00171) 0.895(DBMET00485;­DBMET03265) 0.795(DBMET00769 )
Antifungal (Pneumocystis)	0.430(DB00440) 0.259(METXBIODB02593) 0.258(DB00250)	0.426(DBMET03021) 0.413(DBMET03026) 0.309(DBMET03027 )
Corticotropin releasing factor antagonist	0.048(METXBIODB00046) 0.032(METXBIODB00228) 0.027(METXBIODB01792)	0.025(CHEMBL3526547) 0.018(METXBIODB00048) 0.009(DBMET00535;­METXBIODB00955 )
CDC25A inhibitor	0.577(DB00169) 0.415(METXBIODB02278) 0.400(METXBIODB01980)	0.666(METXBIODB02429) 0.470(METXBIODB01981) 0.457(METXBIODB01168 )
Leukocyte elastase inhibitor	0.285(DB00417) 0.282(DB00790) 0.269(CHEMBL29;­DB01053)	0.338(DBMET01312;­METXBIODB02868) 0.331(METXBIODB02601) 0.288(METXBIODB02253 )
Sirtuin 2 inhibitor	0.201(DB04665) 0.176(METXBIODB00307) 0.155(METXBIODB00237;­METXBIODB01309)	0.124(DBMET01637;­METXBIODB00308) 0.104(DBMET03101;­DBMET03197) 0.101(METXBIODB00309 )
Nicotinic alpha4beta2 receptor antagonist	0.648(CHEMBL3;­DB00184;­METXBIODB02230) 0.374(DB01156;­METXBIODB00109;­METXBIODB01854) 0.370(METXBIODB01383)	0.629(CHEMBL6200;­DBMET00520) 0.603(DBMET03469;­DBMET03471) 0.434(CHEMBL3544718;­DBMET00533 )
Phosphodiesterase 1C inhibitor	0.867(DB00862) 0.853(DB00203) 0.520(METXBIODB00046)	0.856(DBMET03640) 0.696(DBMET00182) 0.640(DBMET00421;­METXBIODB01331 )
Estrogen receptor alpha antagonist	0.983(METXBIODB00549) 0.938(CHEMBL691;­DB00977;­METXBIODB01784) 0.915(DB00481;­METXBIODB01232)	0.951(DBMET03029) 0.941(METXBIODB01234) 0.938(DBMET00457 )
Lysophosphatidic acid 2 receptor antagonist	0.417(DB11677) 0.369(METXBIODB02270) 0.355(METXBIODB01129)	0.358(METXBIODB01130) 0.323(METXBIODB00722) 0.321(DBMET00546;­METXBIODB00763 )
Baculoviral IAP repeat-containing protein 4 inhibitor	0.056(DB01255) 0.037(DB01577;­DB05521;­METXBIODB01797) 0.031(DB00130)	0.654(CHEMBL3526373) 0.061(CHEMBL3544766) 0.050(DBMET01269 )
Aldehyde oxidase substrate	0.965(DB11421) 0.957(CHEMBL34259) 0.951(DB00426)	0.978(CHEMBL731;­DBMET00019) 0.960(DBMET00464) 0.956(DBMET03673;­DBMET03706 )
Histone deacetylase 7 inhibitor	0.813(CHEMBL483254) 0.760(DB06176) 0.554(DB02546)	0.604(CHEMBL3527527) 0.449(DBMET01443) 0.422(DBMET01414 )
Ryanodine receptor antagonist	0.362(DB01219) 0.335(DB13853) 0.195(DB00698)	0.249(DBMET02057) 0.195(METXBIODB02112) 0.173(DBMET00751 )
Cholecystokinin A antagonist	0.867(METXBIODB00496) 0.670(METXBIODB00500) 0.431(DB09268)	0.924(DB11100) 0.811(METXBIODB00499) 0.807(METXBIODB00497;­METXBIODB00498 )
Melatonin 2 antagonist	0.396(DB01065) 0.031(METXBIODB00287) 0.026(METXBIODB01023;­METXBIODB01089)	0.051(DBMET00411) 0.045(METXBIODB00012) 0.034(METXBIODB00534 )
Glutamate (mGluR8) agonist	0.193(DB00130) 0.185(DB00129) 0.179(METXBIODB00273)	0.389(DB00142) 0.176(DB03091) 0.172(DBMET01477 )
Glyceraldehyde-3-phosphate dehydrogenase inhibitor	0.840(DB00640) 0.649(DB01280) 0.615(DB00242)	0.982(DBMET00769) 0.974(DB00171) 0.973(CHEMBL1237125;­DBMET00657 )
Vanilloid 3 antagonist	0.162(METXBIODB00169) 0.111(DB01656) 0.082(METXBIODB01030)	0.240(METXBIODB00170) 0.096(DBMET00376) 0.091(DBMET01607;­DBMET01608;­DBMET01609;­DBMET01610;­METXBIODB00421;­METXBIODB00422;­METXBIODB00423;­METXBIODB00424 )
Cyclin D2 inhibitor	0.972(DB09073) 0.023(DB00592) 0.021(METXBIODB00176)	0.905(DBMET02380) 0.843(DBMET02373) 0.756(DBMET02363;­DBMET02364 )
Carbonic anhydrase X inhibitor	0.119(CHEMBL1046;­DB00513) 0.112(DB13966) 0.109(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.109(DB03796;­DB08231;­DBMET03460) 0.098(CHEMBL1157;­DBMET00501) 0.090(DBMET01477 )
Carbonic anhydrase VIII inhibitor	0.119(CHEMBL1046;­DB00513) 0.112(DB13966) 0.109(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.109(DB03796;­DB08231;­DBMET03460) 0.098(CHEMBL1157;­DBMET00501) 0.090(DBMET01477 )
Sulfotransferase substrate	0.984(CHEMBL691;­DB00977;­METXBIODB01784) 0.983(DB04574) 0.979(DB04575)	0.995(CHEMBL1614648) 0.994(CHEMBL3544597;­DBMET03018) 0.992(DBMET00606 )
RNA-directed RNA polymerase stimulant	0.604(DB02901) 0.549(DB00624;­METXBIODB02276) 0.539(DB01536;­METXBIODB00393)	0.631(CHEMBL261514) 0.610(DBMET02830) 0.604(DBMET00558 )
Myeloperoxidase inhibitor	0.544(DB01275) 0.538(METXBIODB00288) 0.488(METXBIODB00287)	0.488(DBMET01359) 0.433(DBMET01361;­METXBIODB01090) 0.396(DBMET00534 )
Antihypoxic	0.954(CHEMBL3527416) 0.929(CHEMBL1783834) 0.920(METXBIODB03141)	0.954(CHEMBL4525115) 0.950(CHEMBL3526994) 0.947(CHEMBL3526995 )
Melatonin receptor 1A antagonist	0.618(DB01065) 0.102(METXBIODB01089) 0.067(METXBIODB00287)	0.138(DBMET00411) 0.112(METXBIODB00012) 0.110(METXBIODB00534 )
Nav1.2 sodium channel blocker	0.769(DB00836) 0.657(METXBIODB01173) 0.550(DB12532)	0.740(DBMET01697) 0.575(DBMET01778) 0.562(METXBIODB01174 )
Prostaglandin EP4 agonist	0.511(DB00770) 0.510(DB00287) 0.395(DB01240)	0.640(DB00917) 0.521(DBMET02588) 0.511(DBMET02086 )
Methionyl aminopeptidase 1 inhibitor	0.256(DB00730) 0.106(METXBIODB01220) 0.096(DB00507)	0.200(DBMET01768) 0.194(CHEMBL3988902) 0.159(DBMET01944 )
Geranyltranstransferase inhibitor	0.133(METXBIODB02568;­METXBIODB02799) 0.130(DB09031) 0.120(METXBIODB02681)	0.140(DBMET01174) 0.138(DBMET01175) 0.137(DBMET01176 )
Heat shock protein 70 antagonist	0.654(DB00640) 0.341(METXBIODB02838) 0.337(METXBIODB02861;­METXBIODB03112)	0.970(DB00171) 0.897(DBMET02967) 0.867(DBMET00485;­DBMET03265 )
CYP1A2 substrate	0.993(CHEMBL269732;­DB00864;­METXBIODB00828;­METXBIODB00831;­METXBIODB01048) 0.985(METXBIODB02869) 0.983(DB00361)	0.993(CHEMBL3544602;­CHEMBL3544709;­CHEMBL3544837;­METXBIODB00832) 0.992(CHEMBL3544693;­CHEMBL3544708;­DBMET00390;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.991(CHEMBL3544838;­METXBIODB01049 )
Dopamine D3 antagonist	0.810(DB06016) 0.737(DB06077) 0.686(DB13345)	0.742(DBMET03491) 0.666(DBMET03492) 0.547(METXBIODB00900 )
Dopamine D4 antagonist	0.982(DB06077) 0.952(DB01238) 0.892(DB00246)	0.889(DBMET00106) 0.887(DBMET02464) 0.791(DBMET01611 )
Angiotensin AT2 receptor agonist	0.045(DB01124) 0.023(METXBIODB01087) 0.018(CHEMBL498;­DB00672)	0.027(DBMET00289) 0.024(CHEMBL3544766) 0.012(DBMET00502 )
Sodium/glucose cotransporter inhibitor	0.953(DB09038) 0.948(CHEMBL1770248;­DB11827) 0.889(DB06292)	0.995(CHEMBL3526185;­CHEMBL3527604;­DBMET01910;­DBMET01911) 0.977(DBMET01912) 0.962(DBMET02142 )
Glutamate release inhibitor	0.735(DB00740) 0.713(CHEMBL741;­DB00555) 0.470(DB01043)	0.529(DBMET01737) 0.515(DBMET01738) 0.449(DBMET01739 )
Lipoprotein disorders treatment	0.993(CHEMBL1064;­DB00641;­METXBIODB01371;­METXBIODB01748) 0.989(CHEMBL503;­DB00227;­METXBIODB01008) 0.975(DB00175)	0.993(CHEMBL1201391;­DBMET00388) 0.989(CHEMBL3544679;­DBMET01699) 0.988(CHEMBL3544664 )
NOS3 expression inhibitor	0.973(CHEMBL1454) 0.969(CHEMBL413;­DB00877;­METXBIODB01375) 0.966(METXBIODB00817)	0.996(DB03947) 0.993(DBMET03077) 0.969(CHEMBL3544651;­DBMET00389;­DBMET00628;­DBMET01748;­DBMET03075;­METXBIODB00818;­METXBIODB01376 )
Methylmalonyl-CoA mutase inhibitor	0.066(DB00640) 0.037(DB09357;­DB11204) 0.033(DB00118;­DB00242)	0.893(DB04045) 0.731(DB03699) 0.548(DBMET03175 )
HCV NS3/NS4A protease inhibitor	0.871(DB11586) 0.593(DB05521) 0.131(DB00188)	0.843(DBMET02051) 0.766(DBMET02050) 0.600(DBMET02049 )
Dopamine D5 agonist	0.399(DB00988;­METXBIODB01513) 0.364(METXBIODB01512) 0.247(METXBIODB02244)	0.339(DBMET03133) 0.282(DBMET00534) 0.269(DBMET02440 )
Sphingosine 1-phosphate receptor 1 antagonist	0.290(DB05016) 0.272(DB08868) 0.271(DB12612)	0.907(DBMET03096) 0.273(DBMET03312) 0.193(DBMET01879 )
Antibiotic Carbapenem-like	0.952(DB06211) 0.721(DB00303) 0.003(DB03088;­METXBIODB02370)	0.009(DBMET01407) 0.004(DBMET00494) 0.003(DBMET03577 )
2,3-Oxidosqualene-lanosterol cyclase inhibitor	0.348(DB00857) 0.206(METXBIODB02568;­METXBIODB02799) 0.205(DB00175)	0.249(DBMET00068) 0.205(DBMET02472) 0.193(DBMET01204 )
Ornithine carbamoyltransferase inhibitor	0.796(DB00129) 0.785(DB00118) 0.751(DB00130)	0.972(DB00171) 0.937(DBMET00485;­DBMET03265) 0.899(DBMET00514 )
Glutamate (mGluR1a) agonist	0.205(DB00130) 0.184(DB00129) 0.143(METXBIODB02509)	0.304(DB00142) 0.234(DBMET00486) 0.213(DBMET03688 )
Calcium antagonist	0.980(DB00622) 0.963(METXBIODB02115) 0.954(METXBIODB02040)	0.923(DBMET01949) 0.859(DBMET01832) 0.832(METXBIODB00443 )
Caspase 3 inhibitor	0.239(DB09292) 0.211(DB06819) 0.209(DB06218)	0.291(CHEMBL3544766) 0.256(DBMET01476) 0.252(CHEMBL3988902 )
Neuropathy treatment	0.689(DB00922) 0.461(DB01017) 0.459(DB01234;­METXBIODB00696)	0.578(CHEMBL4525758;­DBMET00595) 0.531(DBMET01319;­METXBIODB02245) 0.525(DBMET03456 )
Integrin alpha5beta6 antagonist	0.013(CHEMBL1046;­DB00513) 0.012(DB00181) 0.009(DB03766)	0.018(DBMET00502) 0.015(CHEMBL1157;­DBMET00501;­DBMET00688) 0.014(DBMET00505;­DBMET01477 )
Arginase inhibitor	0.259(DB00129) 0.185(CHEMBL1046;­DB00513) 0.160(METXBIODB03141)	0.954(CHEMBL3526838) 0.355(DBMET00502) 0.291(DBMET00508 )
Dihydroorotate dehydrogenase inhibitor	0.431(CHEMBL686;­DB00784) 0.313(DB09216) 0.257(CHEMBL898)	0.684(CHEMBL237987) 0.650(DBMET00226) 0.606(CHEMBL3544804 )
NMDA receptor phencyclidine site antagonist	0.768(METXBIODB02244) 0.530(CHEMBL52440;­DB00514;­METXBIODB00707) 0.206(METXBIODB01170)	0.768(CHEMBL2105152;­DBMET01318) 0.682(CHEMBL1254766;­DB14682;­METXBIODB00708) 0.663(CHEMBL1638;­DBMET00225;­METXBIODB00709 )
Thyroid hormone agonist	0.705(DB00279;­METXBIODB02434) 0.676(DB00451;­DB00509;­METXBIODB02811) 0.140(METXBIODB03150)	0.809(DBMET00559) 0.727(DBMET02275) 0.689(DBMET02578 )
Vesicular glutamate transport inhibitor	0.138(DB03793;­METXBIODB02476) 0.084(METXBIODB01594) 0.078(METXBIODB01093)	0.179(DBMET01180;­METXBIODB02015) 0.148(METXBIODB00322) 0.138(DB02746;­DBMET01437 )
Phosphodiesterase I inhibitor	0.980(DB00203) 0.835(DB00862) 0.732(METXBIODB00471)	0.818(DBMET00182) 0.788(DBMET03640) 0.676(DBMET00421;­METXBIODB01331 )
Fumarate hydratase inhibitor	0.842(DB00640) 0.538(DB01280) 0.496(DB08908)	0.975(DB00171) 0.958(DBMET00485;­DBMET03265) 0.907(CHEMBL3638285 )
Antineoplastic, alkylator	0.970(METXBIODB03049) 0.963(DB01181;­METXBIODB00963) 0.932(DB12902;­METXBIODB00967)	0.970(DBMET00024;­METXBIODB00966) 0.951(DBMET01682) 0.926(CHEMBL3706539 )
Papain-like protease (SARS coronavirus) inhibitor	0.431(METXBIODB02568;­METXBIODB02799) 0.409(METXBIODB00855) 0.392(DB01012)	0.576(METXBIODB03144) 0.524(DB12148) 0.416(DBMET01841 )
Glutamate (mGluR4) antagonist	0.341(METXBIODB02368) 0.312(DB00129) 0.297(METXBIODB02370)	0.368(DB00142) 0.290(DB00123) 0.233(CHEMBL3544626 )
Carbonic anhydrase XI inhibitor	0.040(CHEMBL1046;­DB00513;­DB13966) 0.038(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450;­METXBIODB02370) 0.034(DB11677)	0.064(CHEMBL804;­DBMET00977) 0.052(CHEMBL574) 0.038(CHEMBL1157;­DB03796;­DB08231;­DBMET00501;­DBMET03460 )
Ileal bile acid transport inhibitor	0.407(METXBIODB03034) 0.305(DB02659;­METXBIODB00251) 0.271(DB01586;­METXBIODB00939)	0.300(DBMET00553) 0.271(DB06777) 0.204(DBMET03598 )
Plasmepsin II inhibitor	0.419(DB01601) 0.141(METXBIODB00531) 0.107(CHEMBL24;­DB00335)	0.312(DBMET03071) 0.132(DBMET03070) 0.129(CHEMBL3544766 )
Glutamate dehydrogenase inhibitor	0.851(DB00640) 0.824(DB00130) 0.806(DB00129)	0.974(DB00171) 0.948(DBMET00485;­DBMET03265) 0.914(DBMET00769 )
Glutamate (mGluR1a) antagonist	0.136(DB00339) 0.135(DB12911) 0.125(METXBIODB00917)	0.191(CHEMBL3706537) 0.113(DBMET03522) 0.105(DBMET01777;­DBMET01958 )
Prostaglandin EP4 antagonist	0.828(DB00770) 0.691(DB00287) 0.661(DB00929)	0.871(DB00917) 0.841(DBMET02588) 0.828(DBMET02086 )
Vasodilator	0.996(DB00727;­DB06154) 0.981(DB09282) 0.964(DB01020)	0.996(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.987(DB13400) 0.953(DBMET02011 )
Epoxide hydrolase 1 inhibitor	0.070(CHEMBL1076347) 0.057(METXBIODB00891) 0.056(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.061(DBMET02688) 0.058(DBMET00341;­METXBIODB00824) 0.057(DBMET03290 )
Antifungal (Aspergillus)	0.593(CHEMBL64391;­DB01167;­METXBIODB00524) 0.358(DB06697) 0.347(METXBIODB00454)	0.593(CHEMBL4525087;­CHEMBL4525088) 0.409(METXBIODB00526) 0.356(DBMET00374;­METXBIODB00525 )
Mannosidase inhibitor	0.899(CHEMBL3527223) 0.596(DB11217) 0.535(DB01914;­DB09419;­DB11735)	0.856(DBMET02088) 0.806(DBMET00509) 0.766(CHEMBL80254 )
Prostacyclin agonist	0.939(DB01240) 0.481(DB00374) 0.469(DB00770)	0.515(DB00917) 0.472(DBMET03506) 0.469(DBMET02086 )
Acetylcholine muscarinic agonist	0.829(DB00185;­METXBIODB00507) 0.528(DB01591) 0.525(METXBIODB01623)	0.829(DBMET00430;­DBMET00431;­DBMET00433) 0.779(METXBIODB00508) 0.436(METXBIODB01624 )
Irritable Bowel syndrome treatment	0.919(DB09089) 0.918(METXBIODB00334) 0.902(DB01062;­METXBIODB00150)	0.936(DBMET01398) 0.931(DBMET01568;­DBMET03354;­METXBIODB00151) 0.921(DBMET01505 )
Postcoital contraceptive	0.849(METXBIODB01739) 0.834(DB00834) 0.723(DB00367)	0.803(DBMET03029) 0.783(METXBIODB01138) 0.742(METXBIODB01740 )
5-Alpha-reductase 2 inhibitor	0.912(CHEMBL710;­DB01216) 0.584(METXBIODB01980) 0.578(DB02789;­METXBIODB01189)	0.834(CHEMBL3542374) 0.709(CHEMBL4525755) 0.584(DBMET03598 )
Myristoyl transferase inhibitor	0.064(DB09225) 0.062(METXBIODB02333) 0.057(METXBIODB01158)	0.098(DBMET03527) 0.091(DBMET01795) 0.062(DB00891 )
Carcinogenic, group 2A	0.993(DB00773;­METXBIODB00808) 0.990(DB00444) 0.971(CHEMBL417;­CHEMBL53463;­DB00997)	0.992(DBMET00367;­DBMET01264;­METXBIODB00809) 0.989(DBMET01265) 0.988(DBMET01262;­DBMET01761 )
Nicotinic acid receptor 1 agonist	0.456(METXBIODB02587) 0.406(METXBIODB02059) 0.403(DB00900)	0.539(DB14132) 0.394(DBMET00496) 0.368(METXBIODB02060 )
Anticataract	0.689(DB14001) 0.672(CHEMBL49563;­DB00163) 0.613(METXBIODB01980)	0.784(DBMET00599;­METXBIODB02578) 0.764(CHEMBL4106241) 0.756(DBMET03361 )
Antineoplastic (insulinoma)	0.178(METXBIODB00565) 0.080(METXBIODB00273) 0.071(METXBIODB00276)	0.250(METXBIODB00566) 0.104(DBMET01591) 0.069(CHEMBL804;­DBMET00977 )
Estradiol 17 beta-dehydrogenase 3 inhibitor	0.691(DB00655;­METXBIODB02494) 0.677(DB05087) 0.646(METXBIODB00781)	0.691(DBMET00490) 0.646(DBMET00248;­DBMET01659) 0.624(DBMET03006;­METXBIODB02215 )
Acetylcholine M1 receptor agonist	0.832(DB00185;­METXBIODB00507) 0.522(DB01591) 0.517(METXBIODB01623)	0.832(DBMET00430;­DBMET00431;­DBMET00433) 0.794(METXBIODB00508) 0.414(METXBIODB01624 )
Antibiotic Rifamycin-like	0.664(CHEMBL444633;­DB00615) 0.567(CHEMBL374478) 0.562(METXBIODB01265)	0.536(CHEMBL3544548) 0.459(CHEMBL3544697) 0.416(METXBIODB01267 )
LDLR expression enhancer	0.947(CHEMBL1064;­DB00641;­METXBIODB01371) 0.890(CHEMBL503;­DB00227;­METXBIODB01008) 0.858(DB00294)	0.917(DBMET01699) 0.845(DBMET03024) 0.830(CHEMBL1627649;­CHEMBL3544577;­DBMET03022 )
Acetyl-CoA transferase 1 inhibitor	0.259(METXBIODB01434) 0.247(METXBIODB00891) 0.203(DB00818;­METXBIODB01201)	0.252(CHEMBL3526310) 0.209(DBMET02251) 0.203(DBMET00625 )
Carboxypeptidase B inhibitor	0.614(DB11296) 0.183(DB00230) 0.138(DB00129)	0.223(DBMET00502) 0.222(DBMET01483) 0.156(DB00123 )
NMDA receptor agonist	0.921(DB06741) 0.868(METXBIODB01959) 0.657(METXBIODB01958)	0.926(METXBIODB02241) 0.868(DBMET01818) 0.614(DB00123 )
Thymidine kinase (Herpes simplex virus 2) inhibitor	0.545(DB00432) 0.276(CHEMBL917;­DB00322) 0.144(CHEMBL991)	0.276(DBMET03584) 0.196(DBMET03190) 0.177(DBMET00496 )
Vitamin D receptor agonist	0.930(CHEMBL846;­DB00136) 0.921(METXBIODB02719) 0.782(DB00169)	0.977(CHEMBL3351075;­CHEMBL3542403) 0.961(DBMET02435) 0.921(DBMET02434 )
Cholecystokinin agonist	0.834(DB09268) 0.616(DB04574) 0.103(METXBIODB01674)	0.943(DBMET02101) 0.899(METXBIODB02254) 0.889(METXBIODB02557 )
Farnesoid X receptor agonist	0.661(DB01586;­METXBIODB00939) 0.646(DB02659;­METXBIODB00251) 0.550(METXBIODB02278)	0.661(DB06777) 0.550(METXBIODB00941) 0.534(METXBIODB00250 )
GABA B receptor antagonist	0.776(METXBIODB01947) 0.759(METXBIODB00075) 0.530(DB00181)	0.274(CHEMBL117) 0.220(METXBIODB01948) 0.216(METXBIODB01366 )
Thrombopoietin agonist	0.069(CHEMBL898) 0.023(METXBIODB01301) 0.019(CHEMBL686;­DB00784;­DB01250)	0.050(DBMET00686) 0.026(DBMET03565) 0.024(CHEMBL1222314 )
Glucose-dependent insulinotropic receptor agonist	0.116(DB01628) 0.108(METXBIODB00552) 0.089(METXBIODB00811)	0.089(DBMET00167) 0.071(DBMET03403) 0.056(CHEMBL3526729;­METXBIODB00553 )
Melatonin 2 agonist	0.981(METXBIODB02687) 0.972(METXBIODB02699) 0.952(METXBIODB02733;­METXBIODB02772;­METXBIODB02922)	0.732(DBMET01457) 0.452(DBMET00411) 0.430(DBMET01456 )
Antiprotozoal (Toxoplasma)	0.991(CHEMBL532;­DB00199) 0.987(CHEMBL1741;­DB01211;­METXBIODB00619) 0.959(DB00778;­METXBIODB01286)	0.975(CHEMBL2063468;­DBMET01656) 0.969(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.961(CHEMBL1947257 )
NADH dehydrogenase inhibitor	0.897(DB00640) 0.785(DB00242) 0.711(DB01280)	0.962(DB00171) 0.952(DBMET00485;­DBMET03265) 0.895(DBMET00677 )
Bone morphogenic protein 1 inhibitor	0.003(DB01124) 0.002(CHEMBL109;­DB00313;­METXBIODB00522;­METXBIODB00577;­METXBIODB01559) 0.001(DB02546;­DB03017;­DB06716;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450;­METXBIODB01523)	0.761(CHEMBL3526346) 0.014(DBMET01121) 0.013(CHEMBL3527251 )
Retinoid X beta receptor antagonist	0.798(DB00755;­DB00982;­METXBIODB00937) 0.617(METXBIODB01691) 0.363(DB06755)	0.798(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.493(DBMET03633) 0.432(METXBIODB00938 )
Leukotriene B4 antagonist	0.428(METXBIODB02515) 0.408(METXBIODB01547) 0.255(DB11936)	0.528(METXBIODB01549) 0.470(DBMET01607;­DBMET01608;­DBMET01609;­DBMET01610;­METXBIODB00421;­METXBIODB00422;­METXBIODB00423;­METXBIODB00424) 0.469(DBMET01593;­DBMET01606;­DBMET02087;­METXBIODB00407;­METXBIODB00420 )
Thymidine phosphorylase inhibitor	0.873(DB00495) 0.744(CHEMBL917;­DB00322) 0.726(DB09343)	0.744(DBMET03584) 0.718(CHEMBL54918;­DBMET03591) 0.681(DBMET01435 )
Acetyl-CoA transferase inhibitor	0.376(DB00818;­METXBIODB01201) 0.371(METXBIODB00891) 0.366(METXBIODB01434)	0.909(DBMET01466) 0.381(CHEMBL3526310) 0.376(DBMET00625 )
Heme oxygenase inhibitor	0.605(DB01026) 0.174(CHEMBL64391;­DB01167;­METXBIODB00524) 0.115(CHEMBL104)	0.812(DBMET02659) 0.603(DBMET02651) 0.421(DBMET02650 )
5-Alpha-reductase 1 inhibitor	0.909(CHEMBL710;­DB01216) 0.604(DB00396;­METXBIODB01192) 0.560(DB00378)	0.794(CHEMBL3542374) 0.713(CHEMBL4525755) 0.533(DBMET03598 )
Calcium-dependent phospholipase A2 inhibitor	0.209(METXBIODB00891) 0.193(DB11677) 0.172(DB06799)	0.279(DBMET03078) 0.148(DBMET00700) 0.143(DBMET00808 )
G protein-coupled receptor agonist	0.160(METXBIODB00811) 0.159(DB01628) 0.139(METXBIODB00552)	0.160(DBMET00167) 0.143(DBMET01003) 0.093(DBMET00171;­DBMET00172 )
Folate transporter 1 inhibitor	0.898(DB11596) 0.797(CHEMBL34259) 0.768(DB00650)	0.399(DB00116) 0.341(CHEMBL3544661) 0.329(DBMET00528 )
2-Acylglycerol O-acyltransferase 2 inhibitor	0.064(DB08912) 0.010(METXBIODB02919) 0.009(DB01015;­METXBIODB01391)	0.028(DBMET03510) 0.018(DBMET03511) 0.013(METXBIODB00646 )
Melatonin 1 agonist	0.636(DB01065) 0.183(METXBIODB02687) 0.179(METXBIODB02699)	0.719(DBMET01457) 0.473(DBMET00411) 0.352(DBMET01456 )
Guanylate cyclase inhibitor	0.081(DB00640) 0.079(DB00581) 0.077(METXBIODB01011)	0.103(DB00171) 0.097(DBMET00769) 0.095(DBMET00485;­DBMET03265 )
Histamine agonist	0.950(DB00501) 0.611(DB00585) 0.567(DB00863;­METXBIODB01235)	0.950(DBMET03242;­DBMET03243) 0.548(CHEMBL901) 0.471(DBMET00959 )
GRP78 expression inhibitor	0.091(DB00129) 0.086(DB11296) 0.071(CHEMBL3527223)	0.132(DBMET00502) 0.124(DBMET01483) 0.084(DB00123 )
Angiotensin-converting enzyme inhibitor	0.948(DB01197) 0.901(DB00492) 0.889(CHEMBL1314;­DB06823)	0.856(DBMET01138) 0.827(DBMET03082) 0.802(DBMET01139 )
Uridine phosphorylase inhibitor	0.683(CHEMBL917;­DB00322) 0.645(DB00495) 0.484(DB00432)	0.874(CHEMBL886;­DBMET01999;­DBMET03585) 0.849(CHEMBL474163;­DBMET03586) 0.802(DB01861;­DB03501 )
Elastase 3B inhibitor	0.091(CHEMBL25;­DB00945;­DB01139) 0.088(METXBIODB02308) 0.077(DB00493)	0.099(DBMET01195;­METXBIODB00605) 0.070(DBMET00641) 0.067(DBMET01501;­DBMET02609;­DBMET02622 )
Elastase 3A inhibitor	0.091(CHEMBL25;­DB00945;­DB01139) 0.088(METXBIODB02308) 0.077(DB00493)	0.099(DBMET01195;­METXBIODB00605) 0.070(DBMET00641) 0.067(DBMET01501;­DBMET02609;­DBMET02622 )
Elastase 2B inhibitor	0.091(CHEMBL25;­DB00945;­DB01139) 0.088(METXBIODB02308) 0.077(DB00493)	0.099(DBMET01195;­METXBIODB00605) 0.070(DBMET00641) 0.067(DBMET01501;­DBMET02609;­DBMET02622 )
Vasopressin 1B agonist	0.019(DB09059) -0.005(DB01255;­METXBIODB01173) -0.006(DB00330;­DB01018;­DB06824;­METXBIODB03110)	-0.001(DBMET02067) -0.002(CHEMBL3526373) -0.003(CHEMBL1379;­DBMET00502;­DBMET03446;­METXBIODB01174 )
Chronic obstructive bronchitis treatment	0.548(CHEMBL532;­DB00199) 0.522(CHEMBL1741;­DB01211;­METXBIODB00619) 0.428(DB11855)	0.571(CHEMBL2063468;­DBMET01656) 0.547(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.468(CHEMBL3544830;­DBMET00356;­METXBIODB00620 )
Sphingosine 1-phosphate receptor 1 agonist	0.918(DB12612) 0.810(DB12371) 0.639(DB12016)	0.789(DBMET03096) 0.525(DBMET03312) 0.484(DBMET03311 )
Cyclin A1 inhibitor	0.979(DB09073) 0.111(DB00619) 0.109(DB06605)	0.971(DBMET02380) 0.962(DBMET02373) 0.884(DBMET02379 )
Cholecystokinin A agonist	0.829(DB09268) 0.441(DB04574) 0.115(METXBIODB01674)	0.906(DBMET02101) 0.878(METXBIODB02254) 0.870(METXBIODB02557 )
Autism spectrum disorders treatment	0.991(METXBIODB00817) 0.981(CHEMBL413;­DB00877;­METXBIODB01375) 0.968(DB06287)	0.985(METXBIODB00819) 0.981(DBMET00628;­METXBIODB00818) 0.974(CHEMBL3544651;­DBMET00389;­DBMET01748;­METXBIODB01376 )
Melatonin agonist	0.832(METXBIODB02687) 0.811(METXBIODB02699) 0.722(METXBIODB02733;­METXBIODB02772;­METXBIODB02922)	0.697(DBMET01457) 0.454(DBMET00411) 0.325(DBMET01456 )
Death-associated protein kinase 2 inhibitor	0.644(DB06595) 0.617(METXBIODB03012) 0.531(CHEMBL535)	0.617(DBMET01043) 0.616(DBMET01440) 0.609(DBMET01441 )
1-Alkyl-2-acetylglycerophosphocholine esterase inhibitor	0.270(DB09031) 0.230(CHEMBL6;­DB00328;­METXBIODB00921) 0.187(DB00605)	0.246(DBMET01002) 0.244(CHEMBL800;­DBMET00156;­METXBIODB00922) 0.234(DBMET00252 )
CXC chemokine 4 receptor agonist	0.035(DB00458;­METXBIODB00907) 0.032(DB01151;­METXBIODB00909) 0.030(DB00129)	0.055(DBMET01959) 0.038(DBMET00502) 0.037(CHEMBL3526373 )
Mannitol-1-phosphate 5-dehydrogenase inhibitor	0.818(DB00640) 0.679(DB01280) 0.619(CHEMBL1076930)	0.954(DB00171;­DB01861;­DB03501) 0.925(DBMET00485;­DBMET03265) 0.910(CHEMBL3526610 )
Melanocortin 5 antagonist	0.277(DB01195) 0.185(METXBIODB01951) 0.127(METXBIODB01173)	0.302(DBMET03194) 0.279(DBMET03192) 0.255(DBMET00840 )
Aminopeptidase A inhibitor	0.139(DB01197) 0.114(DB06151) 0.071(DB00130)	0.420(DBMET00803) 0.252(DBMET01883) 0.235(DBMET00503;­DBMET00508 )
CXC chemokine 5 receptor antagonist	0.458(DB06652) 0.048(METXBIODB00552) 0.035(METXBIODB02370)	0.827(DBMET00080) 0.761(DBMET00083) 0.650(DBMET00078 )
Cholecystokinin antagonist	0.770(METXBIODB00496) 0.612(METXBIODB00500) 0.340(DB09268)	0.945(DB11100) 0.723(METXBIODB00499) 0.718(METXBIODB00497;­METXBIODB00498 )
NMDA 2C receptor antagonist	0.758(METXBIODB02244) 0.725(DB01043) 0.540(METXBIODB01496)	0.770(CHEMBL1254766;­DB14682;­METXBIODB00708) 0.758(CHEMBL2105152;­DBMET01318) 0.693(DBMET01317 )
Thymidine kinase inhibitor	0.834(DB00495) 0.818(DB00432) 0.757(CHEMBL917;­DB00322)	0.974(CHEMBL3526610) 0.970(DBMET03588) 0.965(DBMET03587 )
Transcription factor RelA inhibitor	0.151(METXBIODB02986;­METXBIODB03010) 0.148(METXBIODB00815) 0.144(METXBIODB02202)	0.151(CHEMBL214321;­CHEMBL90568) 0.148(METXBIODB00816) 0.144(CHEMBL187265 )
Dihydroorotate oxidase inhibitor	0.281(CHEMBL160;­DB00091) 0.142(DB00499) 0.138(CHEMBL112;­DB00316;­METXBIODB02370)	0.807(DBMET00226) 0.226(METXBIODB01810) 0.225(CHEMBL3544879 )
Squalene epoxidase inhibitor	0.403(DB00857) 0.361(METXBIODB02063) 0.295(METXBIODB02133)	0.432(DBMET01203) 0.425(DBMET01204) 0.359(DBMET00068 )
Thyroid hormone beta agonist	0.475(DB00279;­METXBIODB02434) 0.448(DB00451;­DB00509;­METXBIODB02811) 0.089(METXBIODB02990)	0.625(DBMET02275) 0.465(DBMET01365) 0.351(DBMET02273 )
Adenosine A1 receptor antagonist	0.929(DB00640) 0.921(DB00242) 0.919(DB00631)	0.963(CHEMBL3526900) 0.812(DBMET00496) 0.738(DBMET01160 )
Microtubule formation inhibitor	0.935(DB06772) 0.932(CHEMBL92;­DB01248) 0.891(METXBIODB00466)	0.948(DBMET00998) 0.947(DBMET00999) 0.932(DBMET00633 )
3C-like protease (Human coronavirus) inhibitor	0.424(METXBIODB02370) 0.414(DB04665) 0.408(METXBIODB00312;­METXBIODB00858)	0.372(CHEMBL1222314) 0.355(DBMET00070) 0.347(DBMET01637;­METXBIODB00308 )
Telomerase stimulant	0.095(CHEMBL1783834) 0.066(DB11217) 0.061(DB00581)	0.356(CHEMBL3542279;­CHEMBL3542281) 0.245(CHEMBL3542286;­CHEMBL3542287) 0.095(CHEMBL3542280;­CHEMBL4525725 )
Leukotriene antagonist	0.980(CHEMBL787;­DB00471) 0.732(METXBIODB00658) 0.540(METXBIODB02380)	0.985(CHEMBL3526239) 0.984(CHEMBL3526241;­DBMET01246;­DBMET01247;­DBMET01707;­DBMET01708) 0.983(CHEMBL3526481;­DBMET01248;­DBMET01249;­DBMET01709 )
DOPA decarboxylase inhibitor	0.620(DB00190) 0.573(DB00279;­METXBIODB02434) 0.562(DB00451;­DB00509;­METXBIODB02811)	0.681(DBMET02273) 0.597(DBMET02274) 0.513(DBMET00251;­METXBIODB00869 )
G-protein-coupled receptor 120 agonist	0.211(DB01241;­METXBIODB03090) 0.189(DB06819) 0.156(METXBIODB00762)	0.205(DBMET01597;­METXBIODB00411) 0.204(DBMET02785) 0.180(DBMET00510 )
Cannabinoid receptor agonist	0.360(DB00470) 0.261(METXBIODB00070) 0.202(DB00889;­METXBIODB00874)	0.317(CHEMBL3706477) 0.283(DBMET00120;­DBMET01785) 0.210(METXBIODB00200 )
Glutamate decarboxylase inhibitor	0.967(CHEMBL1430) 0.945(DB00129) 0.914(CHEMBL1046;­DB00513)	0.969(DBMET00503) 0.967(DBMET00508) 0.949(DB00123;­DB00142 )
Integrin alphaVbeta6 antagonist	0.622(METXBIODB01514) 0.021(DB00129;­DB00130) 0.020(CHEMBL1046;­DB00513)	0.524(METXBIODB01515) 0.335(METXBIODB01517) 0.100(METXBIODB01516 )
Antimetabolite	0.811(DB00441) 0.773(DB00631) 0.753(DB01101)	0.969(CHEMBL3526610) 0.959(DBMET00859) 0.957(CHEMBL3638285 )
Glutamate (mGluR3) agonist	0.122(CHEMBL109;­DB00313;­DB01235;­METXBIODB01559) 0.105(DB13848) 0.099(DB00130)	0.193(DB00142) 0.161(DBMET00506) 0.146(DBMET01108 )
GABA uptake inhibitor	0.323(DB05087) 0.275(METXBIODB00689) 0.161(DB06282)	0.161(DB00341) 0.150(METXBIODB00690) 0.141(CHEMBL3544654;­DBMET00378 )
Melatonin 1 antagonist	0.653(DB01074;­METXBIODB00067) 0.502(DB01065) 0.495(METXBIODB02687)	0.558(DBMET01457) 0.301(DBMET00411) 0.233(DBMET00839;­DBMET00914;­DBMET01547;­METXBIODB00068;­METXBIODB00069 )
Thymidine kinase (Herpes simplex virus 1) inhibitor	0.721(DB00432) 0.465(CHEMBL917;­DB00322) 0.414(DB00900)	0.680(DBMET00496) 0.491(DBMET01435) 0.465(DBMET03584 )
Factor XII inhibitor	0.988(DB06799) 0.284(DB09059) 0.246(DB06176)	0.435(CHEMBL1379) 0.261(DBMET00502) 0.204(DBMET02067 )
3-Hydroxyanthranilate 3,4-dioxygenase inhibitor	0.220(METXBIODB02337) 0.188(DB03793;­METXBIODB02476) 0.178(DB00244)	0.269(DB02362;­DBMET01429) 0.230(DBMET01128) 0.225(DBMET03556 )
Adenylate cyclase 1 stimulant	0.000(METXBIODB02524) -0.001(DB02901;­DB03852;­DB06824;­DB13178;­METXBIODB00171;­METXBIODB01643;­METXBIODB02607;­METXBIODB02813;­METXBIODB02979) -0.002(DB13747;­METXBIODB02562)	-0.001(CHEMBL1213529;­DB02817;­DBMET00558;­DBMET01146;­DBMET01491;­DBMET01573;­DBMET01574;­DBMET01812;­DBMET02114;­DBMET02381;­DBMET02382;­DBMET02832;­DBMET02833;­DBMET02834;­DBMET03359;­METXBIODB00172;­METXBIODB00173;­METXBIODB01640;­METXBIODB01915) -0.002(CHEMBL3638321;­DBMET02080;­DBMET03358;­DBMET03360) -0.003(CHEMBL1157;­CHEMBL1367;­CHEMBL3544550;­CHEMBL3544564;­CHEMBL3544778;­CHEMBL3544797;­CHEMBL610;­CHEMBL721;­DB01677;­DB01955;­DB02083;­DB02325;­DB04325;­DB09401;­DB09526;­DB13169;­DB13526;­DBMET00060;­DBMET00247;­DBMET00392;­DBMET00451;­DBMET00501;­DBMET00505;­DBMET01126;­DBMET01430;­DBMET01456;­DBMET01457;­DBMET01477;­DBMET01495;­DBMET01497;­DBMET01586;­DBMET01762;­DBMET01763;­DBMET01828;­DBMET01973;­DBMET02012;­DBMET02709;­DBMET02710;­DBMET02761;­DBMET02831;­DBMET02835;­DBMET03083;­DBMET03256;­DBMET03257;­METXBIODB00072;­METXBIODB00170;­METXBIODB00380;­METXBIODB00395;­METXBIODB00666;­METXBIODB00814;­METXBIODB01175;­METXBIODB01437;­METXBIODB01563;­METXBIODB01644;­METXBIODB01914;­METXBIODB01998;­METXBIODB03139 )
Antithrombocytopenic	0.637(DB08877) 0.621(METXBIODB01691) 0.597(DB12010)	0.717(DBMET00345) 0.703(DBMET03261) 0.658(CHEMBL4525784 )
Uterine relaxant	0.974(DB09059) 0.381(DB00871) 0.374(DB00816)	0.514(DBMET00840) 0.381(DBMET03275;­DBMET03276) 0.323(DBMET03357 )
Toll-Like receptor 8 antagonist	0.183(DB08865) 0.164(CHEMBL515387) 0.145(METXBIODB00006)	0.175(DBMET01944) 0.133(DBMET01613) 0.127(DBMET02020 )
Beta 3 adrenoreceptor antagonist	0.528(DB00960) 0.512(DB00264;­METXBIODB00121) 0.484(DB01136;­METXBIODB00129)	0.607(DBMET00115;­DBMET00119;­METXBIODB00133) 0.557(DBMET00118;­METXBIODB00131) 0.524(DBMET00740 )
Liver X receptor beta agonist	0.215(METXBIODB01728) 0.182(METXBIODB00262) 0.167(DB00573)	0.204(DBMET01003) 0.197(DBMET00171;­DBMET00172) 0.147(METXBIODB00263 )
Bcl-xL inhibitor	0.188(METXBIODB02351) 0.160(METXBIODB00090;­METXBIODB03094) 0.152(DB11581)	0.184(DBMET00789) 0.160(METXBIODB02352) 0.156(METXBIODB01603 )
Vitamin D receptor antagonist	0.761(CHEMBL846;­DB00136) 0.582(METXBIODB02719) 0.577(DB00169)	0.721(DBMET02435) 0.698(CHEMBL3542380;­CHEMBL3542386) 0.688(CHEMBL3544529;­DBMET00575 )
AMPA 3 receptor antagonist	0.359(DB00129) 0.227(DB00130) 0.194(CHEMBL1046;­DB00177;­DB00513)	0.368(DB00123) 0.207(DB00142) 0.200(METXBIODB01281 )
Thiol protease inhibitor	0.487(DB06670) 0.443(DB00881) 0.429(DB00584;­METXBIODB00946)	0.651(DBMET01475) 0.595(CHEMBL3544766) 0.513(CHEMBL3526373 )
Carboxypeptidase B2 inhibitor	0.497(DB11296) 0.128(DB00230) 0.045(DB00129)	0.165(DBMET01483) 0.087(DBMET00502) 0.059(DB00123 )
Cholecystokinin B antagonist	0.815(METXBIODB00496) 0.615(METXBIODB00500) 0.326(DB09268)	0.908(DB11100) 0.750(METXBIODB00499) 0.740(METXBIODB00497;­METXBIODB00498 )
Sodium-dependent vitamin C transporter 2 inhibitor	0.666(CHEMBL139;­DB00586;­METXBIODB00345) 0.654(DB06736) 0.639(METXBIODB00729)	0.666(DBMET01501;­DBMET02609;­DBMET02622) 0.639(CHEMBL1030;­DBMET00144) 0.631(CHEMBL1035;­DBMET00146 )
Purinergic P2X1 antagonist	0.482(DB00640) 0.287(DB01250) 0.260(DB00244)	0.883(DB00171) 0.790(DBMET00485;­DBMET03265) 0.619(DBMET02967 )
DNA topoisomerase III inhibitor	0.020(METXBIODB01177;­METXBIODB02413) 0.019(METXBIODB02395) 0.018(DB04168;­METXBIODB01121;­METXBIODB02611)	0.020(DBMET00278;­METXBIODB01842) 0.017(DBMET00498) 0.016(DBMET00285 )
M17 leucyl aminopeptidase inhibitor	0.779(METXBIODB01947) 0.340(DB01250) 0.337(METXBIODB02721)	0.779(METXBIODB01948) 0.458(CHEMBL3527192) 0.445(CHEMBL3544771 )
Transcortin receptor antagonist	0.939(DB04630) 0.937(DB00687) 0.922(DB00741;­METXBIODB01729)	0.917(CHEMBL3542319;­DBMET00353) 0.902(DBMET02900;­DBMET02901;­DBMET02902) 0.899(CHEMBL131;­DBMET00627 )
Sphingosine 1-phosphate receptor agonist	0.932(DB12612) 0.841(DB12371) 0.699(DB12016)	0.814(DBMET03096) 0.594(DBMET03312) 0.565(DBMET03311 )
Glutamate (mGluR6) agonist	0.171(DB00130) 0.167(DB01235) 0.154(DB00129)	0.496(DB00142) 0.195(DBMET00486) 0.143(DB03091 )
AMPA receptor antagonist	0.239(METXBIODB00273) 0.217(METXBIODB01893) 0.216(METXBIODB01030)	0.399(METXBIODB00897) 0.224(CHEMBL3542349) 0.222(METXBIODB01033 )
Histamine N-methyltransferase inhibitor	0.568(DB00608;­METXBIODB00114) 0.523(CHEMBL71;­DB00477;­METXBIODB00583) 0.501(DB01611)	0.669(DBMET00514) 0.517(DBMET02741;­DBMET03063;­METXBIODB01837;­METXBIODB02047) 0.486(DBMET01362 )
Retinoid X alpha receptor antagonist	0.708(DB00755;­DB00982;­METXBIODB00937) 0.521(METXBIODB01691) 0.334(METXBIODB03098)	0.708(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.517(DBMET03633) 0.406(DBMET00453 )
Peroxisome proliferator-activated receptor alpha antagonist	0.756(CHEMBL186179;­METXBIODB01057) 0.693(CHEMBL2104978) 0.229(CHEMBL672;­DB01039)	0.756(CHEMBL4525110) 0.728(CHEMBL254989;­METXBIODB01058) 0.693(CHEMBL4525111;­CHEMBL4525112;­CHEMBL4525113;­CHEMBL4525114;­CHEMBL4525116;­CHEMBL4525117;­CHEMBL4525118 )
Dopamine autoreceptor agonist	0.754(DB05271) 0.695(DB01238) 0.397(DB09128)	0.558(DBMET01611) 0.482(DBMET01612) 0.459(DBMET02464 )
Purinergic P2Y1 agonist	0.207(DB00242) 0.198(DB00640) 0.155(DB00631)	0.532(DBMET00677) 0.491(DB00171) 0.368(DBMET00485;­DBMET03265 )
Melatonin antagonist	0.708(DB01074;­METXBIODB00067) 0.592(METXBIODB02687) 0.577(DB01065)	0.591(DBMET01457) 0.382(DBMET00411) 0.307(DBMET00839;­DBMET00914;­DBMET01547;­METXBIODB00068;­METXBIODB00069 )
Alpha 1 adrenoreceptor agonist	0.725(DB00656) 0.706(DB00490) 0.694(METXBIODB02830)	0.660(METXBIODB02107) 0.638(DBMET02603;­DBMET02604) 0.585(DBMET02991 )
Nicotinic receptor alpha3 subunit antagonist	0.564(METXBIODB01541) 0.428(CHEMBL3;­DB00184;­METXBIODB02230) 0.415(DB01156;­METXBIODB00109;­METXBIODB01854)	0.666(DBMET03469;­DBMET03471) 0.528(DBMET00840) 0.377(DBMET02065 )
Prostaglandin EP2 antagonist	0.801(DB00770) 0.765(DB00929) 0.731(DB00905)	0.809(DB00917) 0.801(DBMET02086) 0.785(DBMET02637 )
Excitatory amino acid transporter 3 inhibitor	0.118(DB00130) 0.066(CHEMBL109;­DB00313;­METXBIODB01559) 0.052(DB00129)	0.207(DB00142) 0.094(DBMET01401) 0.082(CHEMBL3706509;­DBMET01109 )
Melanocortin 3 antagonist	0.233(METXBIODB01173) 0.141(DB09059) 0.134(DB01018)	0.737(DBMET00840) 0.255(DBMET00502) 0.179(DBMET02067 )
Potassium channel (Voltage-sensitive) activator	0.260(METXBIODB02391) 0.172(DB00740) 0.160(METXBIODB02793)	0.199(DBMET02248) 0.175(DBMET01579) 0.140(DBMET00091 )
HMG CoA reductase inhibitor	0.939(METXBIODB01748) 0.929(CHEMBL1064;­DB00641;­METXBIODB01371) 0.913(CHEMBL503;­DB00227;­METXBIODB01008)	0.939(CHEMBL1201391;­DBMET00388) 0.926(CHEMBL1201373) 0.922(DBMET01699 )
Kainate receptor 1 antagonist	0.281(DB06741) 0.269(DB00129) 0.266(DB00130)	0.388(CHEMBL1367;­DBMET00060;­METXBIODB01563) 0.275(DB00123) 0.260(CHEMBL116111 )
Antiepileptic	0.994(DB00273) 0.993(METXBIODB01490) 0.988(CHEMBL413;­DB00877;­METXBIODB01375)	0.989(DBMET02909;­DBMET02910) 0.988(DBMET00628;­METXBIODB00818) 0.987(CHEMBL3544651;­DBMET00389;­DBMET01748;­METXBIODB00819;­METXBIODB01376 )
Glutamate (mGluR1) antagonist	0.319(METXBIODB01030) 0.293(METXBIODB01715) 0.204(DB00730)	0.264(METXBIODB01716) 0.223(METXBIODB01033) 0.191(DBMET00993 )
Potassium channel KCNQ activator	0.167(METXBIODB02391) 0.063(METXBIODB01438;­METXBIODB02345) 0.054(DB01012)	0.106(DBMET02248) 0.092(DBMET01579) 0.055(DBMET00091 )
Delayed rectifier potassium channel activator	0.167(METXBIODB02391) 0.063(METXBIODB01438;­METXBIODB02345) 0.054(DB01012)	0.106(DBMET02248) 0.092(DBMET01579) 0.055(DBMET00091 )
GABA transporter 3 inhibitor	0.202(DB00129;­DB06282) 0.193(CHEMBL1046;­DB00513) 0.192(DB00557)	0.202(DB00341) 0.201(DB00123) 0.184(DBMET01193;­METXBIODB00603 )
Retinoid X receptor antagonist	0.721(DB00755;­DB00982;­METXBIODB00937) 0.539(METXBIODB01691) 0.361(METXBIODB03098)	0.721(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.539(DBMET03633) 0.433(DBMET00453 )
Apolipoprotein B inhibitor	0.053(METXBIODB00006) 0.037(DB06698) 0.033(METXBIODB00295)	0.045(CHEMBL3526518) 0.031(DBMET01591) 0.025(DBMET01777 )
Toll-Like receptor 2 agonist	0.234(DB11677) 0.231(DB00130;­DB08887;­DB13966) 0.227(DB00129)	0.371(DBMET01886;­DBMET01887) 0.271(CHEMBL3706542) 0.255(DBMET00506 )
Cannabinoid CB2 receptor agonist	0.298(DB00470) 0.247(METXBIODB00070) 0.207(METXBIODB00552)	0.182(CHEMBL3706477) 0.168(DBMET00120;­DBMET01785) 0.156(CHEMBL3706522 )
Phosphodiesterase 4A inhibitor	0.916(METXBIODB01645) 0.689(DB01656) 0.532(DB00862)	0.866(DBMET00997) 0.851(METXBIODB01646) 0.671(METXBIODB00936 )
Adenosine A2a receptor agonist	0.462(DB00640) 0.271(DB00242) 0.190(DB00631)	0.215(CHEMBL3526900) 0.208(DBMET00485;­DBMET03265) 0.145(DBMET00514 )
Antibiotic	0.985(DB00778;­METXBIODB01286) 0.970(METXBIODB01048) 0.955(CHEMBL532;­DB00199)	0.977(METXBIODB01287) 0.970(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.966(CHEMBL3706534 )
Purinergic P2Y6 agonist	0.028(CHEMBL917;­DB00322) 0.009(DB00432) 0.006(CHEMBL853;­DB00441)	0.851(DB01861;­DB03501) 0.440(CHEMBL1774;­DBMET02000;­DBMET03590) 0.373(CHEMBL590981;­DBMET03589 )
Lipid peroxidase inhibitor	0.897(CHEMBL49563;­DB00163) 0.868(DB14002) 0.832(DB14001)	0.903(CHEMBL527285;­DBMET02040;­DBMET02324) 0.854(DBMET02038;­DBMET02322) 0.849(DBMET02036;­DBMET02320 )
Cytokine production inhibitor	0.769(METXBIODB00513) 0.574(CHEMBL269732;­DB00864;­METXBIODB00828) 0.495(DB06781)	0.674(DBMET00450) 0.661(METXBIODB00514) 0.654(CHEMBL3542318 )
Vanilloid agonist	0.782(DB06716) 0.754(METXBIODB02045) 0.654(DB08921;­METXBIODB00055)	0.754(DBMET01188;­METXBIODB00057) 0.731(METXBIODB03158) 0.652(CHEMBL873;­DBMET00148;­METXBIODB00053 )
Bombesin 2 receptor antagonist	0.277(DB11296) 0.137(METXBIODB02458) 0.129(DB00130)	0.261(DBMET01886;­DBMET01887) 0.219(CHEMBL3544766) 0.201(DBMET03515 )
Peroxisome proliferator-activated receptor alpha agonist	0.917(CHEMBL186179;­METXBIODB01057) 0.849(CHEMBL2104978) 0.466(DB01241;­METXBIODB03090)	0.917(CHEMBL4525110) 0.858(METXBIODB01059) 0.853(CHEMBL254989;­METXBIODB01058 )
Glutamate (mGluR group II) antagonist	0.405(METXBIODB02380) 0.133(DB05016) 0.126(DB00339)	0.154(CHEMBL3544524) 0.117(DBMET00005) 0.105(DBMET00693 )
Antineoplastic (brain cancer)	0.966(DB01181;­METXBIODB00963) 0.950(DB12902;­METXBIODB00967) 0.944(CHEMBL88;­DB00531;­METXBIODB00960)	0.970(DBMET01580) 0.949(CHEMBL87658;­DBMET00020;­DBMET00021;­METXBIODB00961;­METXBIODB00964) 0.944(DBMET00022;­DBMET01683;­METXBIODB00965 )
Phosphodiesterase 1B inhibitor	0.940(DB00203) 0.894(DB00862) 0.653(METXBIODB00471)	0.881(DBMET03640) 0.827(DBMET00182) 0.643(DBMET00421;­METXBIODB01331 )
CD80 antagonist	0.016(DB01435;­METXBIODB00398) 0.008(METXBIODB00385) 0.007(METXBIODB02382;­METXBIODB02646;­METXBIODB02721)	0.159(METXBIODB00399) 0.117(DBMET01583;­METXBIODB00386) 0.013(DBMET00003;­DBMET01588;­METXBIODB00400 )
Mannose-6-phosphate isomerase inhibitor	0.511(DB01914;­DB09419;­DB11735) 0.452(DB00581) 0.387(DB00742;­DB11195;­METXBIODB02296)	0.977(DBMET01478) 0.886(DBMET02089) 0.524(DBMET02088 )
Estrogen-related receptor gamma agonist	0.866(METXBIODB01404) 0.840(METXBIODB00268) 0.734(METXBIODB00269)	0.840(CHEMBL2137046;­DBMET00030;­METXBIODB01402) 0.787(CHEMBL4525766;­METXBIODB00270) 0.758(METXBIODB01709 )
Histone deacetylase 10 inhibitor	0.926(METXBIODB02294) 0.902(DB02546) 0.723(DB05015)	0.886(METXBIODB02295) 0.723(DBMET01443) 0.319(CHEMBL3527527 )
GABA receptor antagonist	0.951(METXBIODB01490) 0.864(DB00683;­METXBIODB01040) 0.800(DB00897)	0.942(METXBIODB01491) 0.922(METXBIODB01492) 0.801(DBMET00933 )
Matrix metalloproteinase (membrane-type) inhibitor	0.142(CHEMBL116) 0.138(DB09292) 0.120(DB02546)	0.227(CHEMBL3544766) 0.221(CHEMBL3544779) 0.216(DBMET01401 )
Peroxisome proliferator-activated receptor gamma antagonist	0.949(CHEMBL2104978) 0.802(CHEMBL186179;­METXBIODB01057) 0.405(DB01132)	0.949(CHEMBL4525111;­CHEMBL4525112;­CHEMBL4525113;­CHEMBL4525114;­CHEMBL4525116;­CHEMBL4525117;­CHEMBL4525118) 0.923(CHEMBL3526971) 0.883(CHEMBL3526633 )
Purinergic P2Y antagonist	0.913(DB08816) 0.485(DB00242) 0.432(DB00640)	0.972(DBMET00677) 0.965(CHEMBL3526652;­DB03699) 0.958(DB00171 )
Alpha 2b adrenoreceptor antagonist	0.995(DB13345) 0.992(DB00248) 0.986(METXBIODB00475)	0.954(METXBIODB00477) 0.896(DBMET02090) 0.820(DBMET02651 )
P2 nucleoside transporter inhibitor	0.033(CHEMBL1455) 0.022(DB06824) 0.011(CHEMBL1046;­DB00513)	0.109(CHEMBL3544873) 0.067(CHEMBL3544897;­CHEMBL3544898) 0.064(CHEMBL3544872;­CHEMBL457723 )
Thromboxane antagonist	0.963(METXBIODB00744) 0.919(METXBIODB00097) 0.859(DB11660)	0.962(METXBIODB00746) 0.957(METXBIODB00745) 0.918(METXBIODB00099 )
1,3-Beta-glucan synthase inhibitor	0.047(METXBIODB02646) 0.044(DB15694) 0.037(CHEMBL3527223;­DB09059;­DB13178;­METXBIODB02472)	0.112(METXBIODB02254) 0.100(METXBIODB01642) 0.078(DBMET00549 )
Adenylate cyclase 1 inhibitor	0.134(DB13952;­METXBIODB02488) 0.125(METXBIODB01341;­METXBIODB01387) 0.124(DB00783;­METXBIODB01814)	0.124(DBMET00491;­METXBIODB00083) 0.123(DBMET01573;­DBMET01574;­METXBIODB00172;­METXBIODB00173) 0.122(DBMET00247 )
5 Hydroxytryptamine 5A antagonist	0.904(METXBIODB02830) 0.897(METXBIODB01085) 0.699(DB00669)	0.718(CHEMBL3526504) 0.670(DBMET01362) 0.536(DBMET01361;­METXBIODB01090 )
Melatonin 5 antagonist	0.033(METXBIODB01173) 0.025(DB11296) 0.023(DB01255)	0.033(DBMET00840) 0.031(DBMET01778) 0.019(DBMET03446 )
Vascular adhesion protein 1 inhibitor	0.169(DB00601) 0.152(DB00780) 0.129(DB01043)	0.185(CHEMBL724;­DBMET00354;­DBMET03729;­METXBIODB00201) 0.158(CHEMBL3527414) 0.137(METXBIODB01366 )
Somatostatin 1 agonist	0.315(DB09059) 0.246(DB00279;­METXBIODB02434) 0.238(DB06824)	0.331(DB11100) 0.239(METXBIODB01762) 0.229(DBMET02067 )
Antiprotozoal (Babesia)	0.476(DB00592) 0.473(DB00564) 0.467(METXBIODB02735)	0.451(DBMET03527) 0.445(METXBIODB01813) 0.399(DBMET02709;­METXBIODB00395 )
Retinoprotector	0.749(METXBIODB03034) 0.747(DB01586;­METXBIODB00939;­METXBIODB01504) 0.689(METXBIODB02278)	0.892(METXBIODB03035) 0.889(DBMET00553) 0.887(METXBIODB02547 )
Matrix metalloproteinase inhibitor	0.222(CHEMBL1314;­DB06823) 0.199(CHEMBL116) 0.180(DB06151)	0.347(DBMET02065) 0.329(DBMET02066) 0.297(CHEMBL3544779 )
Alpha 2b adrenoreceptor agonist	0.852(DB00484;­DB04948) 0.705(METXBIODB02856) 0.540(DB00575)	0.324(DBMET00464) 0.250(DBMET00468) 0.241(DBMET00465 )
Antibacterial (Helicobacter pylori)	0.907(DB01129) 0.898(DB00448;­DB05351;­METXBIODB01955) 0.885(CHEMBL902;­DB00927)	0.907(METXBIODB00032) 0.896(DBMET01494;­METXBIODB01957) 0.854(METXBIODB00033 )
GABA A receptor antagonist	0.947(METXBIODB01490) 0.869(DB00683;­METXBIODB01040) 0.810(DB00897)	0.916(METXBIODB01491) 0.908(METXBIODB01492) 0.794(DBMET00933 )
Thyroid hormone alpha agonist	0.758(DB00451;­DB00509;­METXBIODB02811) 0.710(DB00279;­METXBIODB02434) 0.270(METXBIODB01202)	0.780(DBMET02275) 0.545(DBMET02273) 0.525(DBMET02578 )
Potassium channel (ATP-sensitive) activator	0.231(METXBIODB00565) 0.139(DB00922) 0.125(CHEMBL498;­DB00672)	0.364(METXBIODB00566) 0.162(DBMET00376) 0.130(CHEMBL3186899 )
Calcitonin receptor agonist	0.121(DB09059) 0.111(DB11296) 0.090(DB01255)	0.158(CHEMBL3526373) 0.140(DBMET02065) 0.131(DBMET01886;­DBMET01887 )
Histamine H2 receptor antagonist	0.912(DB00501) 0.898(CHEMBL902;­DB00927) 0.897(DB00585)	0.912(DBMET03242;­DBMET03243) 0.911(DBMET02354) 0.852(DBMET01735;­METXBIODB01236 )
Lysine carboxypeptidase inhibitor	0.436(DB00129) 0.426(DB01197) 0.355(DB11296)	0.725(DBMET00502) 0.459(DB00123) 0.397(DBMET00508 )
Thromboxane A2 antagonist	0.960(METXBIODB00744) 0.916(METXBIODB00097) 0.810(METXBIODB01452)	0.959(METXBIODB00746) 0.955(METXBIODB00745) 0.914(METXBIODB00099 )
AICAR transformylase inhibitor	0.628(CHEMBL34259) 0.437(DB00158) 0.338(DB00650)	0.476(DBMET00485;­DBMET03265) 0.465(CHEMBL1812063;­DBMET01152) 0.444(CHEMBL3544661 )
Potassium channel (Inward rectifier) activator	0.234(METXBIODB00565) 0.140(DB00922) 0.129(CHEMBL498;­DB00672)	0.366(METXBIODB00566) 0.164(DBMET00376) 0.132(CHEMBL3186899 )
Diacylglycerol O-acyltransferase inhibitor	0.153(DB02659;­METXBIODB00251) 0.149(METXBIODB02871) 0.129(DB00712;­DB05289;­METXBIODB00141;­METXBIODB02725)	0.140(DBMET02110) 0.120(DBMET01275) 0.115(DB09269;­DBMET01431;­METXBIODB03146 )
Thioredoxin inhibitor	0.483(DB06799) 0.388(METXBIODB01928) 0.374(METXBIODB02033)	0.503(DBMET03682) 0.446(DBMET03683) 0.439(DBMET01434 )
Dihydroorotase inhibitor	0.428(CHEMBL686;­DB00784) 0.409(DB01097;­METXBIODB01809) 0.400(DB09216)	0.669(DBMET00226) 0.621(CHEMBL237987) 0.436(DBMET00946 )
Carbonic anhydrase VB inhibitor	0.900(DB00273) 0.758(CHEMBL902;­DB00927) 0.749(DB00869)	0.871(DBMET02909;­DBMET02910) 0.643(DBMET03010) 0.526(DBMET01349 )
Anticholelithogenic	0.831(DB02659;­METXBIODB00251) 0.794(DB01586;­METXBIODB00939) 0.792(METXBIODB02278)	0.882(METXBIODB03035) 0.830(METXBIODB00250) 0.818(DBMET03599 )
Cholecystokinin B agonist	0.888(DB09268) 0.638(DB04574) 0.156(DB00130)	0.989(DBMET02101) 0.982(METXBIODB02254) 0.976(METXBIODB02557 )
Prostaglandin antagonist	0.957(METXBIODB00097;­METXBIODB00744) 0.905(METXBIODB01452) 0.754(DB00770)	0.888(DB00917) 0.883(DBMET02588) 0.879(METXBIODB00746 )
Hypoxanthine phosphoribosyltransferase inhibitor	0.243(CHEMBL184) 0.229(DB14126) 0.216(DB00787)	0.901(DBMET00769) 0.780(DBMET01155) 0.723(DB00171 )
NMDA receptor subunit 3B antagonist	0.779(DB00451;­DB00509;­METXBIODB02811) 0.748(METXBIODB01959) 0.664(DB06741)	0.748(DBMET01818) 0.689(DBMET02273) 0.632(DBMET02578 )
Carcinogenic, group 2B	0.978(CHEMBL1117) 0.977(CHEMBL417;­CHEMBL53463;­DB00997) 0.973(CHEMBL178;­DB00694)	0.950(METXBIODB01862) 0.942(METXBIODB00356) 0.933(CHEMBL3526411 )
5 Hydroxytryptamine 1D agonist	0.864(DB00315) 0.818(METXBIODB01680) 0.812(DB00669)	0.766(DBMET01792) 0.756(METXBIODB01682) 0.703(DBMET02585 )
Estrogen-related receptor gamma antagonist	0.509(METXBIODB01404) 0.506(METXBIODB00268) 0.262(CHEMBL83;­DB00675;­METXBIODB01400)	0.506(CHEMBL2137046;­DBMET00030;­METXBIODB01402) 0.350(CHEMBL4525766;­METXBIODB00270) 0.254(METXBIODB01709 )
Sphingosine 1-phosphate receptor 5 agonist	0.598(DB08868) 0.454(DB12612) 0.447(DB05016)	0.866(DBMET03096) 0.610(DBMET01507) 0.527(CHEMBL3544550 )
Glutamate (mGluR2) antagonist	0.406(METXBIODB02380) 0.111(DB00339) 0.106(DB05016)	0.092(DBMET00005) 0.080(DBMET00693;­DBMET00814) 0.064(CHEMBL3544524 )
Bombesin 3 receptor antagonist	0.350(DB00214) 0.201(DB01124) 0.199(CHEMBL498;­DB00672)	0.307(DBMET02232) 0.306(DBMET02233) 0.293(DBMET02231 )
Purinergic P2Y2 agonist	0.051(CHEMBL917;­DB00322) 0.045(DB00242) 0.039(DB00631)	0.884(DB01861;­DB03501) 0.637(CHEMBL1774;­DBMET02000;­DBMET03590) 0.582(CHEMBL590981;­DBMET03589 )
5 Hydroxytryptamine 2B agonist	0.786(DB04871) 0.327(DB00248) 0.299(METXBIODB01229)	0.879(CHEMBL3526304) 0.299(DBMET01732;­DBMET01825;­METXBIODB01849) 0.251(DBMET00377;­METXBIODB01001 )
Aromatase inhibitor	0.952(DB00294) 0.947(CHEMBL1200374) 0.927(METXBIODB00694)	0.944(CHEMBL3526952) 0.927(DBMET00723;­DBMET00724;­DBMET01642;­DBMET01643;­METXBIODB00695) 0.886(DBMET02931 )
Progesterone antagonist	0.974(DB00834) 0.942(METXBIODB01739) 0.919(METXBIODB01134)	0.954(DBMET01704) 0.917(DBMET01703) 0.881(METXBIODB01740 )
Glycine transporter 2 inhibitor	0.419(DB11296) 0.382(DB00129) 0.342(METXBIODB00762)	0.425(DB00123) 0.392(DBMET01886;­DBMET01887) 0.364(CHEMBL3544766 )
Dopamine D2 antagonist	0.988(DB13345) 0.982(DB06077) 0.973(DB08815)	0.950(METXBIODB02107) 0.937(DBMET01502;­METXBIODB02109) 0.915(DBMET00323;­METXBIODB01276 )
Factor XIII inhibitor	0.036(METXBIODB01643) 0.031(METXBIODB02333) 0.030(METXBIODB02735)	0.031(DB00891;­METXBIODB01644) 0.028(DBMET01579;­DBMET02709;­METXBIODB00395) 0.024(CHEMBL3184360;­DBMET00014;­DBMET00201 )
Thiazolidinedione	0.871(DB01132) 0.814(DB00412) 0.802(CHEMBL3526905)	0.952(DBMET01300) 0.911(DBMET01365) 0.906(DBMET00942 )
Antihypermotility	0.599(DB06480) 0.528(DB00778;­METXBIODB01286) 0.443(CHEMBL532;­DB00199)	0.624(DBMET02203) 0.603(DBMET02197) 0.590(DBMET02198 )
Sigma 2 receptor antagonist	0.596(METXBIODB01821) 0.364(DB03701;­METXBIODB01568) 0.336(METXBIODB00517)	0.336(CHEMBL1036;­DBMET00104) 0.324(METXBIODB01569) 0.303(CHEMBL4525086;­METXBIODB00519 )
Phosphodiesterase VIII inhibitor	0.137(DB08816) 0.129(CHEMBL585;­DB00384) 0.121(DB01162)	0.192(CHEMBL276521) 0.184(DBMET03171) 0.148(DBMET03170 )
Retinoid X receptor agonist	0.834(DB00755;­DB00982;­METXBIODB00937) 0.729(METXBIODB01691) 0.530(METXBIODB03098)	0.834(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.750(DBMET03633) 0.584(DBMET00453 )
Glucagon receptor antagonist	0.176(DB12255) 0.169(METXBIODB02468) 0.159(DB01218;­METXBIODB00077)	0.214(DBMET00371;­METXBIODB00078) 0.196(DBMET02164) 0.183(DBMET00725 )
NAT1 substrate	0.957(DB01015;­METXBIODB01391;­METXBIODB02653) 0.933(METXBIODB02319) 0.932(METXBIODB02583)	0.975(DBMET00015;­METXBIODB01392) 0.949(DBMET00017) 0.913(METXBIODB01390 )
Hyperparathyroidism treatment	0.977(CHEMBL846;­DB00136) 0.967(METXBIODB02719) 0.937(DB00153;­METXBIODB01575;­METXBIODB02762)	0.985(DBMET02435) 0.967(DBMET02434) 0.961(DBMET02436 )
Beta 2 adrenoreceptor agonist	0.677(DB00938;­METXBIODB01303) 0.637(DB09082) 0.560(DB09080)	0.641(DBMET02956) 0.553(DBMET01394) 0.543(DBMET00386;­METXBIODB01304 )
Antiviral (Hepatitis A)	0.831(CHEMBL160;­DB00091) 0.765(METXBIODB00667) 0.579(METXBIODB01566)	0.830(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.829(CHEMBL3544879) 0.828(CHEMBL3544882;­CHEMBL3544884 )
Beta 1 adrenoreceptor antagonist	0.723(DB00264;­METXBIODB00121) 0.685(DB00187) 0.634(METXBIODB00073;­METXBIODB01835)	0.784(DBMET00319;­METXBIODB00122) 0.648(DBMET00115;­DBMET00119;­METXBIODB00133) 0.585(DBMET00118;­METXBIODB00131 )
Estrogen-related receptor alpha antagonist	0.191(METXBIODB02180) 0.170(DB01132) 0.165(CHEMBL83;­DB00675;­METXBIODB01400;­METXBIODB01404)	0.384(DBMET01300) 0.297(CHEMBL50995;­DBMET02716) 0.244(DBMET01365 )
Benzodiazepine agonist	0.952(METXBIODB00481) 0.894(DB09166;­METXBIODB00801) 0.888(DB00683;­METXBIODB01040)	0.829(METXBIODB00483) 0.816(METXBIODB00353) 0.807(DBMET03600;­METXBIODB00217 )
Interleukin 4 antagonist	0.873(DB01234;­METXBIODB00696) 0.804(CHEMBL269732;­DB00864;­METXBIODB00828) 0.782(METXBIODB01399)	0.891(METXBIODB00750) 0.887(METXBIODB01811) 0.886(DBMET00826 )
Carbonic anhydrase III inhibitor	0.984(DB00273) 0.905(DB00869) 0.893(DB09298)	0.980(DBMET02909;­DBMET02910) 0.927(DBMET02911) 0.912(DBMET01841 )
Antifungal (Cryptococcus)	0.967(DB11638) 0.961(DB06697) 0.953(METXBIODB00454)	0.967(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.963(METXBIODB00455) 0.833(DBMET00827 )
Adenosine A2 receptor agonist	0.695(DB00640) 0.388(DB00242) 0.260(DB00631)	0.304(CHEMBL3526900) 0.247(DBMET00485;­DBMET03265) 0.232(DBMET00514 )
Thrombin receptor antagonist	0.144(CHEMBL493982;­DB09030) 0.108(DB01255) 0.088(METXBIODB00522)	0.166(CHEMBL498785;­DBMET01376) 0.106(DBMET02067) 0.099(CHEMBL3542381 )
Histamine H3 receptor antagonist	0.600(DB01058) 0.550(DB11642) 0.436(CHEMBL515387)	0.335(CHEMBL3527229) 0.319(DBMET00840) 0.302(CHEMBL3526894 )
Kainate receptor antagonist	0.355(DB06741) 0.347(DB00129) 0.346(DB00130)	0.561(DBMET01883) 0.409(CHEMBL1367;­DBMET00060;­METXBIODB01563) 0.348(DB00123 )
Calcium channel L-type activator	0.738(CHEMBL193;­DB01115) 0.731(DB00388;­METXBIODB03123) 0.727(DB00668)	0.746(CHEMBL3544725) 0.737(CHEMBL1573;­DBMET00380;­DBMET02940) 0.727(DBMET02444 )
Antihelmintic (Fasciola)	0.788(DB12245) 0.533(METXBIODB02615) 0.498(METXBIODB02912)	0.514(CHEMBL804;­DBMET00977) 0.510(METXBIODB00195) 0.484(METXBIODB00194 )
Retinoid X alpha receptor agonist	0.893(DB00755;­DB00982;­METXBIODB00937) 0.746(METXBIODB01691) 0.587(METXBIODB03098)	0.893(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.649(DBMET03633) 0.632(DBMET00453 )
Keratolytic	0.773(DB00799) 0.769(DB00755;­DB00982;­METXBIODB00937) 0.665(METXBIODB03098)	0.811(DBMET01005) 0.769(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.742(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
Alpha adrenoreceptor agonist	0.940(DB00484) 0.912(DB13345) 0.903(DB00697;­METXBIODB02082)	0.712(DBMET00465) 0.700(CHEMBL3544803) 0.659(DBMET00464 )
Neurokinin 1 agonist	0.071(DB01255) 0.048(DB11296) 0.016(DB00129;­DB00130)	0.102(DBMET02065) 0.054(DBMET02067) 0.051(CHEMBL3526373 )
AMPA 1 receptor antagonist	0.310(DB00129) 0.267(DB00130) 0.226(DB11296)	0.326(DB00123) 0.302(DBMET00502) 0.237(DBMET02986 )
Potassium channel intermediate-conductance Ca-activated blocker	0.374(CHEMBL104) 0.343(METXBIODB00452) 0.248(METXBIODB01203)	0.183(DBMET01591) 0.149(DBMET02228) 0.145(DBMET01199 )
HCV NS5B polymerase inhibitor	0.964(DB08934) 0.434(DB14761) 0.162(DB00441)	0.915(DBMET01381) 0.912(DBMET01383) 0.858(DBMET01382 )
NMDA receptor glycine site agonist	0.889(DB06741) 0.809(METXBIODB01959) 0.525(METXBIODB01958)	0.809(DBMET01818) 0.499(METXBIODB02241) 0.297(DBMET03557 )
5 Hydroxytryptamine 2A agonist	0.864(METXBIODB00475) 0.795(DB13345) 0.662(METXBIODB00010)	0.951(CHEMBL3526304) 0.766(METXBIODB00477) 0.612(DBMET01359 )
Arylamine N-Acetyltransferase substrate	0.973(METXBIODB01071) 0.910(METXBIODB01901) 0.898(METXBIODB01900)	0.967(CHEMBL3544870) 0.947(DBMET01050) 0.943(METXBIODB02521 )
Melatonin 3 antagonist	0.276(METXBIODB01173) 0.139(DB01065) 0.065(DB01018)	0.203(DBMET03446) 0.190(METXBIODB01174) 0.180(DBMET00840 )
Bradykinin B1 receptor agonist	0.003(DB01255) 0.002(DB00129) -0.001(DB00130)	0.009(CHEMBL3526373) 0.008(DBMET00502) 0.002(DB00123;­DBMET02067 )
Nicotinic alpha4beta2 receptor agonist	0.274(CHEMBL3;­DB00184;­METXBIODB02230) 0.159(METXBIODB01383) 0.090(METXBIODB00647)	0.257(CHEMBL6200;­DBMET00520) 0.090(CHEMBL578211;­DBMET00519) 0.084(DBMET03527 )
3-Oxoacyl-[acyl-carrier-protein] synthase inhibitor	0.792(METXBIODB02133) 0.633(METXBIODB02879) 0.601(METXBIODB01399)	0.838(DB03699) 0.766(DBMET03175) 0.676(METXBIODB02134;­METXBIODB02135 )
Sigma 1 receptor antagonist	0.766(DB03701;­METXBIODB01568) 0.640(DB01075;­METXBIODB00738) 0.632(METXBIODB02611)	0.680(METXBIODB01569) 0.532(METXBIODB01570) 0.516(DBMET00086 )
Human herpes virus 5 capsid protein P40 inhibitor	0.047(METXBIODB00204) 0.046(METXBIODB02319) 0.043(METXBIODB02321)	0.128(METXBIODB00213) 0.106(METXBIODB00267) 0.097(METXBIODB00349 )
Gastric antisecretory	0.985(DB01129) 0.978(DB00448;­DB05351;­METXBIODB01955) 0.965(DB00213;­METXBIODB00543)	0.985(METXBIODB00032) 0.983(DBMET03755) 0.972(DBMET01494;­METXBIODB01957 )
Caspase 8 inhibitor	0.041(DB00121) 0.034(DB09292) 0.030(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.053(CHEMBL3544766) 0.040(DBMET01121;­DBMET01401) 0.034(DBMET01119;­DBMET03515 )
Phenylalanine 4-hydroxylase inhibitor	0.819(DB01235) 0.815(DB00126) 0.788(DB00368)	0.841(DBMET00503) 0.788(DBMET02443) 0.719(DBMET02444 )
Pulmonary hypertension treatment	0.947(DB15456) 0.756(METXBIODB01526) 0.754(DB00374)	0.947(DBMET03244;­DBMET03245) 0.803(CHEMBL3526838) 0.787(METXBIODB01527 )
Cathepsin L1 inhibitor	0.925(DB06670) 0.653(DB05521) 0.128(DB01255)	0.942(DBMET01475) 0.860(DBMET01472) 0.190(DBMET01469 )
Nav1.3 sodium channel blocker	0.685(DB00836) 0.540(CHEMBL479;­DB00679;­METXBIODB02074) 0.527(CHEMBL71;­DB00477;­METXBIODB00583)	0.652(DBMET01697) 0.540(METXBIODB01314) 0.528(DBMET00825;­METXBIODB00586 )
Vanilloid 2 antagonist	0.290(CHEMBL151649;­METXBIODB02558) 0.270(METXBIODB02270) 0.269(METXBIODB00762)	0.288(CHEMBL2074871) 0.277(DBMET01600;­METXBIODB00414) 0.269(DBMET00546;­METXBIODB00763 )
Nicotinic alpha4 receptor agonist	0.238(CHEMBL3;­DB00184;­METXBIODB02230) 0.165(METXBIODB01383) 0.103(DB00592;­METXBIODB01229)	0.252(CHEMBL6200;­DBMET00520) 0.115(METXBIODB01278) 0.103(DBMET01732;­DBMET01825;­METXBIODB01849 )
Vesicular acetylcholine transporter inhibitor	0.320(METXBIODB01821) 0.206(METXBIODB00517) 0.099(DB06217)	0.206(CHEMBL1036;­DBMET00104) 0.184(METXBIODB01386) 0.100(CHEMBL1254766;­DB14682;­METXBIODB00708 )
Epoxide hydrolase inhibitor	0.269(DB00398) 0.256(CHEMBL1076347) 0.219(DB01043)	0.262(DBMET03323) 0.185(CHEMBL3706477) 0.182(DBMET02153 )
Bulimia treatment	0.397(DB00472;­DB08472;­DB08544;­METXBIODB01953) 0.309(DB00289;­METXBIODB00158) 0.262(DB01183)	0.396(DB06731;­DBMET00197;­DBMET01807;­METXBIODB01954) 0.308(DBMET02304) 0.240(DBMET00321;­METXBIODB01140 )
Prostaglandin H2 antagonist	0.480(METXBIODB00744) 0.381(METXBIODB00097) 0.265(METXBIODB01452)	0.279(METXBIODB00746) 0.267(METXBIODB00745) 0.208(METXBIODB00099 )
Leukotriene synthesis inhibitor	0.780(DB00744) 0.777(CHEMBL2105653) 0.637(CHEMBL787;­DB00471)	0.655(DBMET00139;­METXBIODB00065) 0.602(CHEMBL3526239) 0.595(CHEMBL3526240 )
Integrin alphaVbeta5 antagonist	0.784(METXBIODB01514) 0.020(CHEMBL1046;­DB00513) 0.017(METXBIODB01173)	0.633(METXBIODB01515) 0.285(METXBIODB01517) 0.158(METXBIODB01516 )
Beta 2 adrenoreceptor antagonist	0.731(DB00983) 0.634(DB00264;­METXBIODB00121) 0.599(DB00187)	0.779(DBMET02956) 0.702(DBMET00319;­METXBIODB00122) 0.654(DBMET00740 )
Purine nucleoside phosphorylase inhibitor	0.700(DB00787) 0.697(CHEMBL184) 0.253(DB02377)	0.700(DBMET02605) 0.533(DBMET01173;­METXBIODB01188) 0.496(DBMET01174 )
Heparanase inhibitor	0.217(DB11217) 0.182(DB11365) 0.156(METXBIODB01980)	0.518(DBMET00553) 0.501(CHEMBL3526428;­CHEMBL3526429) 0.404(METXBIODB02280 )
Prolactin release inhibitor	0.976(METXBIODB00475) 0.972(DB13345) 0.907(METXBIODB00369)	0.994(METXBIODB00275) 0.972(METXBIODB00477) 0.970(METXBIODB00476 )
Adenosine A2b receptor antagonist	0.495(DB00277) 0.424(CHEMBL628;­DB00806) 0.423(DB00201;­METXBIODB00486)	0.569(CHEMBL3526900) 0.496(CHEMBL3544675;­DBMET03234) 0.494(DBMET00222;­DBMET00271 )
Shock treatment	0.950(DB09059) 0.468(DB00129) 0.435(DB00130)	0.734(DBMET00502) 0.526(DBMET02067) 0.515(DBMET00486 )
NMDA 2A receptor antagonist	0.529(METXBIODB01496) 0.500(DB01221;­DB11823;­METXBIODB00118) 0.494(METXBIODB01959)	0.599(DBMET00502) 0.494(DBMET01818) 0.491(DBMET02274 )
Antiprotozoal (Trichomonas)	0.928(METXBIODB02781) 0.859(DB00916) 0.839(DB00448;­DB05351;­METXBIODB01955)	0.860(DBMET01494;­METXBIODB01957) 0.816(DBMET00186;­DBMET01657;­METXBIODB00774) 0.803(METXBIODB00032 )
Kainate receptor 4 antagonist	0.203(CHEMBL445990) 0.180(METXBIODB01280) 0.149(METXBIODB00278;­METXBIODB00297)	0.204(METXBIODB00919) 0.168(DBMET00993) 0.129(DBMET00494;­METXBIODB01282 )
Somatostatin 1 antagonist	0.260(DB09059) 0.152(CHEMBL160;­DB00091;­DB06176) 0.102(DB00129)	0.369(DBMET03190) 0.195(DBMET02662) 0.160(CHEMBL3544640 )
Potassium channel Kv1.1 blocker	0.223(DB00414) 0.221(METXBIODB00565) 0.186(DB00214)	0.457(METXBIODB00566) 0.171(DBMET02982) 0.142(DBMET01591 )
Melanocortin 4 antagonist	0.322(METXBIODB01173) 0.141(DB09059) 0.090(DB01131)	0.611(DBMET00840) 0.228(DBMET02067) 0.127(DBMET00502 )
Diamine oxidase inhibitor	0.440(METXBIODB00880) 0.419(DB00780) 0.299(METXBIODB01173)	0.240(DBMET01955) 0.225(DB13410;­METXBIODB00881) 0.219(CHEMBL610;­DB04325 )
Liver X receptor beta antagonist	0.156(METXBIODB00811) 0.124(METXBIODB03047) 0.114(DB01628)	0.186(DBMET00171;­DBMET00172) 0.156(DBMET00167;­DBMET00693) 0.150(METXBIODB00521 )
Hemostatic	0.950(DB15456) 0.770(METXBIODB01752) 0.716(DB06695)	0.950(DBMET03244;­DBMET03245) 0.913(DBMET02415) 0.888(DBMET02416 )
Acetylcholine M2 receptor antagonist	0.826(DB11855) 0.718(METXBIODB01623) 0.694(DB01591)	0.660(DBMET02191) 0.599(DBMET00746) 0.581(DBMET00381;­METXBIODB00153 )
Apolipoprotein B-100 inhibitor	0.042(METXBIODB00006) 0.030(CHEMBL3542265;­METXBIODB00295) 0.028(CHEMBL455136)	0.035(CHEMBL3526518) 0.028(CHEMBL4525144;­CHEMBL4525145;­CHEMBL4525146;­CHEMBL4525147;­CHEMBL4525148;­CHEMBL4525149;­CHEMBL4525150;­CHEMBL4525151;­CHEMBL4525152;­CHEMBL4525153;­CHEMBL4525154;­CHEMBL4525155;­CHEMBL4525156;­CHEMBL4525157;­CHEMBL4525158;­CHEMBL4525159) 0.024(DBMET01591 )
Antipruritic	0.998(CHEMBL1473;­DB00588) 0.997(DB08906) 0.995(DB06781)	0.995(DBMET00837) 0.992(DBMET02589) 0.986(DBMET02590 )
Epithelial sodium channel blocker	0.285(METXBIODB01173) 0.182(DB01018) 0.155(DB13729)	0.270(METXBIODB01174) 0.187(DBMET01778) 0.176(DBMET00502 )
Metalloproteinase-3 inhibitor	0.104(DB06151) 0.099(CHEMBL109;­DB00313;­METXBIODB01559) 0.086(DB02546;­DB09292)	0.280(CHEMBL3526373) 0.219(CHEMBL3544766) 0.214(CHEMBL3544779 )
TRPA1 antagonist	0.636(DB00201;­METXBIODB00486) 0.546(CHEMBL628;­DB00806) 0.384(CHEMBL151649;­METXBIODB02558)	0.636(DBMET00535) 0.538(METXBIODB00716) 0.393(METXBIODB00490 )
Dihydropteroate synthase inhibitor	0.453(DB00158) 0.446(DB01015;­METXBIODB01391) 0.405(METXBIODB02919)	0.405(DBMET01049) 0.384(DBMET00017) 0.366(DBMET00016 )
Dipeptidyl peptidase II inhibitor	0.564(DB01261) 0.517(DB04876) 0.242(CHEMBL515387)	0.250(DBMET02432) 0.195(CHEMBL3526894) 0.150(DBMET03319 )
Neuraminidase (Influenza A) inhibitor	0.680(DB00198) 0.169(DB00742;­DB11195) 0.137(METXBIODB02365)	0.715(DBMET02218) 0.193(DBMET03118) 0.148(CHEMBL3544842 )
Melanocortin antagonist	0.329(METXBIODB01173) 0.221(DB09059) 0.143(DB01195)	0.532(DBMET00840) 0.271(DBMET03194) 0.257(DBMET02067 )
Corticotropin releasing factor 1 receptor antagonist	0.095(METXBIODB01792) 0.087(METXBIODB00228) 0.076(CHEMBL1455)	0.077(CHEMBL4525761) 0.060(METXBIODB01640) 0.057(CHEMBL3527249 )
Dementia treatment	0.917(DB00922) 0.901(DB01043) 0.777(DB01020)	0.974(DBMET02761) 0.870(DB12243) 0.762(DBMET03138;­DBMET03151;­DBMET03156 )
Vitamin D-like	0.894(METXBIODB02719) 0.782(CHEMBL846;­DB00136) 0.521(DB00153;­METXBIODB01575;­METXBIODB02762)	0.983(DBMET02435) 0.894(DBMET02434) 0.883(METXBIODB01576 )
5 Hydroxytryptamine 5 antagonist	0.894(METXBIODB02830) 0.890(METXBIODB01085) 0.668(DB00669)	0.713(CHEMBL3526504) 0.661(DBMET01362) 0.529(DBMET01359 )
4-Hydroxyphenylpyruvate dioxygenase inhibitor	0.046(METXBIODB01030) 0.035(METXBIODB03045) 0.032(CHEMBL1308;­DB01213)	0.057(DBMET01195;­METXBIODB00605) 0.038(DBMET01199) 0.037(METXBIODB01031 )
Growth hormone release inhibitor	0.254(DB09059) 0.186(DB00279;­METXBIODB02434) 0.121(DB06151)	0.201(DBMET00503) 0.166(DBMET02275) 0.142(DBMET02067 )
Ca2+/calmodulin-dependent kinase IV inhibitor	0.912(METXBIODB01288) 0.801(DB06595) 0.408(DB12332)	0.856(METXBIODB01289) 0.764(DBMET01441) 0.757(DBMET01440 )
Vascular dementia treatment	0.916(DB00922) 0.901(DB01043) 0.776(DB01020)	0.974(DBMET02761) 0.869(DB12243) 0.760(DBMET03138;­DBMET03151;­DBMET03156 )
HIV-1 integrase (Overall Integration) inhibitor	0.404(METXBIODB03100) 0.387(DB00244) 0.343(DB01250)	0.651(CHEMBL3526411) 0.495(CHEMBL2030560) 0.387(DBMET00402 )
Apoptosis agonist	0.978(DB06799) 0.962(METXBIODB00715) 0.959(CHEMBL3542194)	0.986(METXBIODB00716) 0.975(CHEMBL3544744) 0.966(DBMET03410 )
Ribonucleoside-diphosphate reductase inhibitor	0.549(DB00631) 0.518(DB00441) 0.365(DB00242)	0.831(DBMET00858) 0.810(DBMET00419) 0.795(DBMET00859 )
Antibiotic Penem-like	0.023(DB00303) 0.022(DB06211) 0.018(METXBIODB01600)	0.020(CHEMBL1207) 0.015(DBMET00641) 0.013(DBMET00646 )
Adrenaline agonist	0.832(DB09080) 0.829(DB00983) 0.815(DB00938;­METXBIODB01303)	0.884(DBMET02956) 0.785(DBMET00386;­METXBIODB01304) 0.719(DBMET01394 )
Antiemphysemic	0.497(METXBIODB01297) 0.399(CHEMBL1473;­DB00588) 0.389(CHEMBL1370;­DB01222;­METXBIODB01745)	0.889(METXBIODB02429) 0.447(DBMET02761) 0.378(CHEMBL3542373;­DBMET02914 )
Dopamine antagonist	0.985(DB06077;­DB13345) 0.969(DB08815) 0.966(DB08922;­METXBIODB02106)	0.940(METXBIODB02107) 0.918(DBMET01502;­METXBIODB02109) 0.916(DBMET00323;­METXBIODB01276 )
Cathepsin L2 inhibitor	0.488(DB06670) 0.425(DB05521) 0.354(DB11763)	0.415(DBMET01475) 0.397(DBMET01472) 0.390(DBMET03719 )
NMDA receptor glycine site antagonist	0.971(DB06741) 0.951(METXBIODB01959) 0.781(METXBIODB01958)	0.951(DBMET01818) 0.539(METXBIODB02241) 0.469(DBMET02986 )
5 Hydroxytryptamine 2 antagonist	0.994(DB13345) 0.980(DB00734;­METXBIODB01274) 0.964(DB06077)	0.972(DBMET02984) 0.969(DBMET02090) 0.946(DBMET00323;­METXBIODB01276 )
Ribonucleotide reductase inhibitor	0.621(DB00631) 0.522(DB00441) 0.429(DB00242)	0.934(DBMET00859) 0.920(DBMET00858) 0.895(DBMET00677 )
Metalloproteinase-2 inhibitor	0.323(DB05015) 0.228(DB01124) 0.222(DB01348)	0.351(DBMET01142) 0.334(CHEMBL3544779) 0.323(DBMET01443 )
NMDA receptor subunit 3A antagonist	0.822(DB00451;­DB00509;­METXBIODB02811) 0.814(DB00279;­METXBIODB02434) 0.759(METXBIODB01959)	0.759(DBMET01818) 0.748(DBMET02273) 0.704(DBMET02578 )
Phosphodiesterase VI inhibitor	0.970(METXBIODB01526) 0.924(DB00203) 0.918(DB00862)	0.891(METXBIODB01527) 0.819(DBMET00421;­METXBIODB01331) 0.815(DBMET03640 )
Phosphodiesterase 6C inhibitor	0.990(DB00862) 0.752(DB00820) 0.370(DB00203)	0.990(DBMET03640) 0.752(DBMET03416) 0.437(DBMET00326 )
Bombesin 1 receptor agonist	0.214(DB11296) 0.166(METXBIODB02544) 0.163(DB00130)	0.245(DBMET00506) 0.234(DBMET01483) 0.224(DBMET02166 )
Estradiol 17 beta-dehydrogenase 1 inhibitor	0.771(DB00655;­METXBIODB02494) 0.688(METXBIODB00781) 0.626(DB00783;­METXBIODB01814)	0.771(DBMET00490) 0.721(DBMET01664) 0.688(DBMET00248;­DBMET01659 )
Kallikrein 7 inhibitor	0.358(METXBIODB02420) 0.305(METXBIODB02449) 0.202(CHEMBL1454)	0.379(CHEMBL3526352) 0.226(METXBIODB02743) 0.177(CHEMBL4525808 )
Peroxisome proliferator-activated receptor delta agonist	0.294(DB01241;­METXBIODB03090) 0.196(CHEMBL672;­DB01039) 0.195(METXBIODB02575)	0.289(DBMET02785) 0.230(CHEMBL981;­DB13873) 0.225(DBMET03281 )
Histamine H4 receptor agonist	0.904(DB00501) 0.203(METXBIODB02400) 0.137(DB00543)	0.904(DBMET03242;­DBMET03243) 0.127(CHEMBL4525085) 0.111(CHEMBL3544897;­CHEMBL3544898 )
Alpha 2c adrenoreceptor antagonist	0.995(DB13345) 0.956(DB00248) 0.954(METXBIODB00475)	0.913(METXBIODB00477) 0.874(DBMET02603;­DBMET02604) 0.855(DBMET02090 )
Amylase inhibitor	0.934(CHEMBL3527223) 0.916(CHEMBL3527416) 0.897(METXBIODB03141)	0.937(CHEMBL3526295) 0.927(CHEMBL3526454) 0.924(CHEMBL3526995 )
Prostaglandin-E synthase inhibitor	0.482(DB04725;­METXBIODB00980) 0.451(METXBIODB00981) 0.406(METXBIODB00982)	0.484(CHEMBL237987) 0.451(DBMET01313) 0.406(DBMET01315 )
Antiviral (Trachoma)	0.930(CHEMBL532;­DB00199) 0.926(CHEMBL1741;­DB01211;­METXBIODB00619) 0.891(CHEMBL374478)	0.912(CHEMBL2063468;­DBMET01656) 0.911(CHEMBL1947257) 0.904(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
Thyroid hormone alpha antagonist	0.878(DB00279;­METXBIODB02434) 0.686(DB00451;­DB00509;­METXBIODB02811) 0.388(METXBIODB01202)	0.960(DBMET02275) 0.511(DBMET02273) 0.443(DBMET01846;­METXBIODB02080 )
Squalene synthetase inhibitor	0.260(METXBIODB02568;­METXBIODB02799) 0.188(METXBIODB02681) 0.157(DB00857)	0.301(METXBIODB00208) 0.197(METXBIODB02569) 0.194(DBMET01434 )
3 Beta-hydroxy-delta 5-steroid dehydrogenase inhibitor	0.058(CHEMBL710;­DB01216) 0.046(DB00396;­METXBIODB01192) 0.043(DB00378)	0.045(CHEMBL3542374;­CHEMBL4525755) 0.037(DBMET01727;­METXBIODB01197) 0.036(DBMET00369 )
Calcium channel T-type blocker	0.311(DB00737) 0.262(DB04841) 0.251(DB00661;­METXBIODB00712;­METXBIODB01669)	0.209(DBMET01197) 0.175(DBMET02576) 0.151(DBMET01198 )
Sphingosine 1-phosphate receptor 3 agonist	0.697(DB08868) 0.430(DB12016) 0.333(DB12371)	0.962(DBMET03096) 0.494(METXBIODB00593) 0.457(DBMET03309 )
Menstruation disorders treatment	0.860(METXBIODB01137) 0.848(CHEMBL1201146) 0.832(DB00294)	0.812(CHEMBL1162) 0.788(DB09389) 0.786(CHEMBL241694;­DBMET00851 )
Reverse transcriptase (HBV) inhibitor	0.011(METXBIODB02345) 0.004(CHEMBL1140;­DB01035;­DB13747;­METXBIODB02562;­METXBIODB02953) 0.002(DB00705;­DB01171;­DB06637;­DB06728;­METXBIODB00446;­METXBIODB00682)	0.006(DBMET02630;­METXBIODB02346) 0.004(DBMET00946;­DBMET01430;­DBMET02629;­DBMET03083) 0.002(CHEMBL3706522;­DB01955;­DBMET00363;­DBMET00919;­DBMET01777;­DBMET02153;­DBMET02709;­METXBIODB00395;­METXBIODB00741;­METXBIODB01640 )
Purinergic P2Y12 antagonist	0.834(DB08816) 0.384(CHEMBL1201772;­DB06209) 0.258(DB00825;­METXBIODB01997;­METXBIODB02957)	0.873(DBMET03170) 0.868(DBMET03171) 0.670(DBMET00498 )
Dopamine beta hydroxylase inhibitor	0.245(DB00763) 0.171(METXBIODB01512) 0.165(DB00988;­METXBIODB01513)	0.140(DBMET00614) 0.136(CHEMBL610;­DB04325) 0.131(DBMET03097 )
Human herpesvirus 2 protease inhibitor	0.002(METXBIODB00458;­METXBIODB01121) 0.001(DB11558;­METXBIODB00446;­METXBIODB01011;­METXBIODB01146;­METXBIODB02140;­METXBIODB02144;­METXBIODB02349) 0.000(METXBIODB00189;­METXBIODB00276;­METXBIODB01430;­METXBIODB01859;­METXBIODB02132;­METXBIODB02138)	0.002(DBMET02761) 0.001(CHEMBL1222314) 0.000(CHEMBL3527184;­DBMET00070;­DBMET01630;­METXBIODB00604;­METXBIODB01644 )
Prostate disorders treatment	0.933(CHEMBL710;­DB01216) 0.731(METXBIODB00826) 0.663(CHEMBL1200374)	0.882(CHEMBL4525755) 0.881(CHEMBL3542374) 0.689(CHEMBL3544689;­DBMET02481 )
Antibiotic Macrolide-like	0.968(CHEMBL532;­DB00199) 0.957(CHEMBL1741;­DB01211;­METXBIODB00619) 0.907(DB00778;­METXBIODB01286)	0.908(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.895(CHEMBL2063468;­DBMET01656) 0.871(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
Imidazoline I1 receptor antagonist	0.593(DB04948) 0.571(DB00575) 0.288(DB13875)	0.158(CHEMBL4525123;­CHEMBL4525124) 0.141(DBMET01360) 0.137(DBMET00468 )
Peptidyltransferase inhibitor	0.899(DB07565) 0.804(CHEMBL532;­DB00199) 0.800(CHEMBL1741;­DB01211;­METXBIODB00619)	0.949(DB00446) 0.909(DBMET03158) 0.898(DBMET03152 )
Purinergic P2T antagonist	0.780(DB08816) 0.662(CHEMBL1201772;­DB06209) 0.496(METXBIODB01752)	0.872(DBMET03170) 0.816(DBMET03171) 0.632(CHEMBL3526431 )
Lysine-specific demethylase 1A inhibitor	0.338(DB15133) 0.171(DB01104) 0.124(DB00780)	0.361(DBMET03250) 0.188(CHEMBL3526372) 0.164(DBMET03249 )
Cocaine dependence treatment	0.994(DB00921) 0.979(METXBIODB01912) 0.975(DB00704;­METXBIODB03062)	0.979(DBMET00174) 0.976(DBMET00760) 0.961(DBMET03370 )
Glucocorticoid agonist	0.989(CHEMBL1473;­DB00588) 0.985(DB08906) 0.954(DB11921)	0.974(DBMET02573) 0.955(DBMET03675) 0.950(DBMET00450 )
Antidote, heavy metal	0.636(CHEMBL1314;­DB06823) 0.475(CHEMBL1430) 0.354(DB06151)	0.592(DBMET01886;­DBMET01887) 0.463(DBMET01883) 0.373(CHEMBL2158192;­DBMET01416 )
Proline transporter inhibitor	0.039(METXBIODB01882) 0.031(METXBIODB01859) 0.030(METXBIODB02341)	0.048(CHEMBL724;­DBMET00354;­DBMET03729;­METXBIODB00201) 0.040(DBMET01777;­DBMET02646) 0.035(DBMET03726 )
CYP2C19 inhibitor	0.910(DB00294) 0.903(CHEMBL1479;­DB01406) 0.893(CHEMBL1393;­DB00421)	0.875(DB09389) 0.856(CHEMBL1162) 0.852(DBMET03030 )
Protein 50S ribosomal subunit inhibitor	0.976(CHEMBL532;­DB00199) 0.971(CHEMBL1741;­DB01211;­METXBIODB00619) 0.934(DB00778;­METXBIODB01286)	0.917(CHEMBL3706534) 0.908(CHEMBL2063468;­DBMET01656) 0.901(CHEMBL3544830;­DBMET00356;­METXBIODB00620 )
Histamine H3 receptor agonist	0.623(DB00501) 0.524(METXBIODB02856) 0.345(DB11296)	0.623(DBMET03242;­DBMET03243) 0.450(DBMET00840) 0.314(DBMET01483 )
Metalloproteinase-9 inhibitor	0.276(DB05015) 0.199(DB01124) 0.197(DB02546)	0.276(DBMET01443) 0.256(CHEMBL3544779) 0.217(CHEMBL3544766 )
LFA antagonist	0.352(CHEMBL503;­DB00227;­METXBIODB01008) 0.117(CHEMBL1064;­DB00641;­METXBIODB01371) 0.110(DB00175)	0.245(CHEMBL1201373) 0.225(CHEMBL3544685) 0.161(DBMET01699 )
Hypolipemic	0.989(CHEMBL1064;­DB00641;­METXBIODB01371) 0.988(METXBIODB01748) 0.980(CHEMBL503;­DB00227;­METXBIODB01008)	0.988(CHEMBL1201391;­DBMET00388) 0.981(CHEMBL3544664;­DBMET01699) 0.980(CHEMBL3544679;­METXBIODB00716 )
Somatostatin 3 antagonist	0.151(DB09059) 0.069(DB06176) 0.058(CHEMBL160;­DB00091)	0.590(DBMET03190) 0.141(DBMET02205) 0.109(CHEMBL1207 )
Phosphodiesterase 6G inhibitor	0.988(DB00862) 0.547(DB00820) 0.184(METXBIODB00471)	0.988(DBMET03640) 0.547(DBMET03416) 0.467(DBMET00326 )
Phosphodiesterase 6H inhibitor	0.988(DB00862) 0.547(DB00820) 0.184(METXBIODB00471)	0.988(DBMET03640) 0.547(DBMET03416) 0.467(DBMET00326 )
Cyclin E2 inhibitor	0.151(DB09073) 0.139(DB06595) 0.075(METXBIODB00917)	0.308(DBMET01440) 0.129(DBMET02371) 0.114(DBMET02378 )
D-Ala-D-Ala ligase inhibitor	0.381(METXBIODB01399) 0.354(METXBIODB00861;­METXBIODB02507) 0.346(METXBIODB00860)	0.336(CHEMBL442289) 0.329(CHEMBL3527009) 0.324(CHEMBL75589 )
Immunosuppressant Cyclosporine-like	0.862(CHEMBL160;­DB00091) 0.642(METXBIODB00667) 0.157(METXBIODB01566)	0.855(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.830(CHEMBL3544879) 0.821(CHEMBL3544882;­CHEMBL3544884 )
Lipocortins synthesis agonist	0.978(DB11921) 0.940(DB00764) 0.923(CHEMBL1473;­DB00588)	0.981(DBMET02573) 0.940(DBMET02361) 0.927(DBMET02591 )
Factor V inhibitor	0.254(DB01914;­DB09419;­DB11735) 0.229(DB14187) 0.220(METXBIODB03135)	0.489(METXBIODB00859) 0.331(CHEMBL721;­DBMET01126) 0.305(METXBIODB00825 )
Sigma receptor antagonist	0.868(DB00704) 0.839(DB01183) 0.836(DB01192)	0.836(DBMET00321;­METXBIODB01140) 0.819(DBMET00760) 0.774(DBMET03370 )
Matrix metalloproteinase 1 inhibitor	0.153(DB05015) 0.117(CHEMBL116) 0.114(DB06151)	0.227(CHEMBL3526373) 0.222(DBMET02065) 0.201(CHEMBL3527294 )
Histone deacetylase class IV inhibitor	0.935(METXBIODB02294) 0.911(DB02546) 0.799(DB05015)	0.877(METXBIODB02295) 0.799(DBMET01443) 0.450(CHEMBL3527527 )
Histone deacetylase 11 inhibitor	0.935(METXBIODB02294) 0.911(DB02546) 0.799(DB05015)	0.877(METXBIODB02295) 0.799(DBMET01443) 0.450(CHEMBL3527527 )
Nicotinic alpha3beta4 receptor agonist	0.278(CHEMBL3;­DB00184;­METXBIODB02230) 0.184(METXBIODB01383) 0.117(METXBIODB00647)	0.360(CHEMBL6200;­DBMET00520) 0.132(CHEMBL3544719;­DBMET00526) 0.117(CHEMBL578211;­DBMET00519 )
CDC25B inhibitor	0.400(METXBIODB01580;­METXBIODB01586) 0.249(METXBIODB00450;­METXBIODB02219) 0.243(METXBIODB02453)	0.391(METXBIODB01583) 0.386(CHEMBL117487;­CHEMBL3706510;­DBMET00065) 0.376(METXBIODB01585;­METXBIODB01588 )
GABA transporter 1 inhibitor	0.125(DB06282) 0.118(DB00557) 0.085(DB03701;­METXBIODB01568)	0.125(DB00341) 0.103(METXBIODB01570) 0.053(DBMET02644 )
Alpha 1d adrenoreceptor agonist	0.268(CHEMBL762;­DB00935) 0.151(METXBIODB02632) 0.145(DB00668)	0.268(CHEMBL4525123;­CHEMBL4525124) 0.175(CHEMBL3526776) 0.156(CHEMBL3526775 )
Dipeptidyl peptidase IV inhibitor	0.994(DB08882) 0.973(DB01261) 0.939(CHEMBL385517;­DB06335)	0.953(CHEMBL3350936;­DBMET00459) 0.944(DBMET02394) 0.938(DBMET02387 )
Histone deacetylase 8 inhibitor	0.932(DB06176) 0.805(CHEMBL483254) 0.780(DB05015)	0.860(CHEMBL3526395) 0.780(DBMET01443) 0.673(CHEMBL3527527 )
Aggrecanase 2 inhibitor	0.049(DB02546) 0.046(METXBIODB01087) 0.042(METXBIODB00204)	0.092(DBMET00056) 0.087(METXBIODB00349) 0.048(DBMET02228 )
Progesterone receptor A antagonist	0.282(DB00603;­METXBIODB02099) 0.214(DB00717) 0.202(DB00834)	0.214(CHEMBL1162) 0.204(CHEMBL241694;­DBMET00851) 0.142(METXBIODB02005 )
Carbonic anhydrase VI inhibitor	0.985(DB00273) 0.927(DB01194) 0.926(DB00869)	0.981(DBMET02909;­DBMET02910) 0.918(DBMET02911) 0.882(DBMET01841 )
Proto-oncogene tyrosine-protein kinase c-hck inhibitor	0.895(METXBIODB01339) 0.532(DB09053) 0.201(DB00437)	0.707(DBMET02020) 0.560(DBMET02027) 0.551(DBMET02025 )
Carbonic anhydrase IV inhibitor	0.627(DB00273) 0.531(DB00869) 0.402(DB01194)	0.477(DBMET02909;­DBMET02910) 0.413(DBMET03010) 0.344(DBMET03671 )
Purinergic P2X4 antagonist	0.324(DB01068) 0.150(DB00580;­DB00640;­DB12110) 0.121(CHEMBL490;­DB00715;­METXBIODB01819)	0.951(DB00171) 0.812(DBMET00485;­DBMET03265) 0.593(DBMET02967 )
Glutamate (mGluR4) agonist	0.223(METXBIODB02353;­METXBIODB02842) 0.169(METXBIODB02333) 0.139(METXBIODB01389)	0.343(DB00142) 0.169(DB00891) 0.122(DBMET00508 )
Calcium channel L-type blocker	0.881(METXBIODB02115) 0.879(DB00622) 0.865(CHEMBL1726;­METXBIODB02040;­METXBIODB02119)	0.810(DBMET01832) 0.782(DBMET01949) 0.781(METXBIODB02122 )
MAP kinase kinase 7 inhibitor	0.196(DB09053) 0.163(DB06595) 0.156(DB00998)	0.170(DBMET01441) 0.167(DBMET02020) 0.156(DBMET00684 )
Antiprotozoal (Amoeba)	0.864(DB06697) 0.818(METXBIODB00454) 0.752(DB11638)	0.752(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.741(METXBIODB00455) 0.571(DBMET01913;­DBMET03143 )
Acetylcholine muscarinic antagonist	0.826(DB11855) 0.805(DB01062;­METXBIODB00150) 0.769(DB01591)	0.793(DBMET00746) 0.763(DBMET02191) 0.749(DBMET00381;­METXBIODB00153 )
Acetylcholine agonist	0.908(DB00185;­METXBIODB00507) 0.659(DB01591) 0.604(METXBIODB01383)	0.908(DBMET00430;­DBMET00431;­DBMET00433) 0.841(METXBIODB00508) 0.494(DBMET00406;­METXBIODB00876 )
Estradiol 17 beta-dehydrogenase inhibitor	0.877(DB00655;­METXBIODB02494) 0.810(METXBIODB00781) 0.778(METXBIODB02214)	0.877(DBMET00490) 0.810(DBMET00248;­DBMET01659) 0.809(DBMET01664 )
Nav1.4 sodium channel blocker	0.311(DB06176) 0.301(DB09059) 0.252(CHEMBL160;­DB00091)	0.900(DBMET01096) 0.322(DBMET00840) 0.285(CHEMBL3542418 )
Somatostatin 4 antagonist	0.318(DB09059) 0.106(METXBIODB02408) 0.105(DB06176)	0.949(DBMET03190) 0.271(DBMET02662) 0.161(DB11100 )
Collagenase 3 inhibitor	0.102(DB02546;­DB05015) 0.096(METXBIODB02233) 0.089(CHEMBL16;­DB00252)	0.180(CHEMBL3527251) 0.169(CHEMBL3526346) 0.160(DBMET03082 )
GABA transporter inhibitor	0.152(DB06282) 0.141(DB00557) 0.100(DB03701;­METXBIODB01568)	0.152(DB00341) 0.120(METXBIODB01570) 0.077(DBMET02644 )
Acetylcholine M3 receptor antagonist	0.770(DB11855) 0.636(DB01591) 0.539(DB01062;­METXBIODB00150)	0.687(DBMET02191) 0.682(DBMET00746) 0.606(DBMET02956 )
Kainate receptor 3 antagonist	0.333(CHEMBL109;­DB00313;­METXBIODB01559) 0.155(CHEMBL445990) 0.141(METXBIODB01861)	0.281(CHEMBL3706509;­DBMET01109) 0.261(DBMET01108) 0.233(CHEMBL1367;­DBMET00060;­METXBIODB01563 )
Phosphoribosylglycinamide formyltransferase inhibitor	0.088(DB00650) 0.083(DB00158) 0.074(DB11596)	0.174(DBMET01476) 0.158(DB00116) 0.121(CHEMBL1231106 )
CYP2A6 inhibitor	0.654(METXBIODB01203) 0.602(METXBIODB00452) 0.594(METXBIODB01034)	0.583(CHEMBL3526330) 0.539(CHEMBL3542349) 0.488(DBMET00953 )
CC chemokine 1 receptor antagonist	0.452(CHEMBL54;­DB00502) 0.403(METXBIODB00517) 0.361(DB00836)	0.490(DBMET01697) 0.452(CHEMBL4525086;­METXBIODB00519) 0.403(CHEMBL1036;­DBMET00104 )
Carbonic anhydrase XV inhibitor	0.972(DB00273) 0.967(DB01194) 0.964(DB00869)	0.970(DBMET02909;­DBMET02910) 0.946(DBMET01349) 0.945(DBMET03671 )
Protein kinase C gamma inhibitor	0.993(DB06595) 0.438(METXBIODB01288) 0.380(METXBIODB01205)	0.996(DBMET01440) 0.989(DBMET01441) 0.414(METXBIODB01289 )
CDK5/p25 inhibitor	0.232(DB04168) 0.102(DB02377) 0.100(CHEMBL64;­METXBIODB02327)	0.179(CHEMBL1442231;­CHEMBL3526371) 0.129(CHEMBL3091852) 0.123(DBMET02372 )
Elastase 1 inhibitor	0.295(METXBIODB00658) 0.239(DB05521) 0.224(DB01139)	0.305(METXBIODB00659) 0.197(METXBIODB01385) 0.184(DBMET01195;­METXBIODB00605 )
Dihydrofolate reductase inhibitor	0.995(CHEMBL34259) 0.944(DB00563) 0.856(DB11596)	0.974(CHEMBL3544661) 0.761(CHEMBL3544676) 0.725(DBMET00467 )
Antibiotic Tribactam-like	0.005(DB00303;­DB06211) 0.004(DB00796) 0.003(METXBIODB01754)	0.003(METXBIODB01755) 0.001(METXBIODB00208) 0.000(CHEMBL3544507;­CHEMBL3544705;­CHEMBL3544706;­CHEMBL3544835;­CHEMBL3638306;­DBMET01407;­DBMET02483;­DBMET02484;­DBMET02485;­DBMET03697;­METXBIODB00051 )
Protein kinase C zeta inhibitor	0.923(DB06595) 0.582(METXBIODB01288) 0.352(METXBIODB02136)	0.976(DBMET01440) 0.831(DBMET01441) 0.495(METXBIODB01289 )
Leukotriene B4 receptor 2 antagonist	0.806(METXBIODB01547) 0.440(METXBIODB00658) 0.126(METXBIODB02515)	0.756(METXBIODB01549) 0.599(METXBIODB01548) 0.490(METXBIODB00659 )
Carbonic anhydrase VA inhibitor	0.920(DB00273) 0.744(CHEMBL902;­DB00927) 0.683(DB00869)	0.891(DBMET02909;­DBMET02910) 0.543(CHEMBL3544765) 0.537(DBMET03010 )
Alpha 2a adrenoreceptor agonist	0.833(DB00697;­METXBIODB02082) 0.737(DB00484) 0.658(DB04948)	0.473(DBMET00468) 0.439(CHEMBL4525123;­CHEMBL4525124) 0.403(DBMET00465 )
Caspase 7 inhibitor	0.164(METXBIODB00312) 0.162(METXBIODB00243) 0.158(CHEMBL1455)	0.166(CHEMBL724;­DBMET00354;­DBMET03729;­METXBIODB00201) 0.164(METXBIODB00490) 0.160(CHEMBL3544872;­CHEMBL457723 )
Glutamate (mGluR group III) agonist	0.354(DB13848) 0.223(METXBIODB02353) 0.206(DB01235)	0.434(DB00142) 0.275(DBMET00486) 0.225(CHEMBL237987 )
Cyclin D1 inhibitor	0.279(DB06595) 0.222(DB09073) 0.199(METXBIODB02968)	0.190(DBMET01441) 0.180(DBMET02380) 0.179(DBMET02363;­DBMET02364 )
Somatostatin 4 agonist	0.302(METXBIODB02408) 0.201(DB09185) 0.184(DB11296)	0.696(CHEMBL3706536) 0.184(METXBIODB01238) 0.164(DBMET03493 )
GABA receptor agonist	0.994(METXBIODB01490) 0.881(METXBIODB00481) 0.817(DB00683;­METXBIODB01040)	0.975(METXBIODB01491) 0.872(DBMET00135;­DBMET00299;­METXBIODB00791) 0.862(METXBIODB01492 )
Histamine H4 receptor antagonist	0.504(DB00501) 0.437(CHEMBL42;­DB00363;­METXBIODB00638) 0.329(DB00370;­METXBIODB01993)	0.504(DBMET03242;­DBMET03243) 0.437(CHEMBL4525085) 0.306(CHEMBL845;­DBMET00100 )
Mucolytic	0.995(DB00778;­METXBIODB01286) 0.994(CHEMBL532;­DB00199) 0.993(CHEMBL1741;­DB01211;­METXBIODB00619)	0.988(METXBIODB01287) 0.986(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.984(DBMET00944 )
Melanocortin 4 agonist	0.055(METXBIODB01173) 0.052(DB09059;­DB11296) 0.043(DB01202)	0.425(DBMET00840) 0.106(DBMET02067) 0.071(DBMET00502 )
Dipeptidyl peptidase inhibitor	0.988(DB08882) 0.972(DB01261) 0.945(CHEMBL385517;­DB06335)	0.959(CHEMBL3350936;­DBMET00459) 0.902(DBMET02394) 0.888(DBMET02387 )
Anticonvulsant	0.993(DB00273) 0.992(METXBIODB01490) 0.955(METXBIODB00481)	0.989(METXBIODB01491) 0.988(DBMET02909;­DBMET02910) 0.981(METXBIODB01492 )
Leukotriene B4 receptor 1 antagonist	0.865(METXBIODB01547) 0.656(DB11936) 0.645(METXBIODB00658)	0.850(METXBIODB01549) 0.672(METXBIODB00659) 0.622(METXBIODB01548 )
Narcolepsy treatment	0.380(CHEMBL1373;­DB00745) 0.318(METXBIODB01085) 0.300(METXBIODB00046)	0.303(METXBIODB01086) 0.301(DBMET03284) 0.272(DBMET00406;­METXBIODB00876 )
Sodium/glucose cotransporter 2 inhibitor	0.946(DB09038) 0.938(CHEMBL1770248;­DB11827) 0.869(DB12713)	0.989(CHEMBL3526185;­CHEMBL3527604;­DBMET01910;­DBMET01911) 0.967(DBMET01912) 0.960(DBMET02143 )
Hematopoietic	0.875(DB01221;­DB11823;­METXBIODB00118) 0.812(DB06595) 0.577(DB00742;­DB11195)	0.855(DBMET00190;­DBMET00191) 0.848(DBMET00192) 0.786(DBMET01440 )
Ca(v)3.2 blocker	0.372(METXBIODB02717) 0.283(METXBIODB02190) 0.243(METXBIODB02183)	0.410(CHEMBL1710849;­DBMET01641) 0.396(DBMET03671) 0.332(CHEMBL3542390;­CHEMBL4525788 )
Liver X receptor alpha agonist	0.344(METXBIODB02278) 0.289(DB01586;­METXBIODB00939) 0.275(METXBIODB03047)	0.349(METXBIODB01981) 0.344(METXBIODB00941) 0.294(DBMET01003 )
Human rhinovirus A protease inhibitor	0.568(DB05521) 0.343(DB08908) 0.311(CHEMBL114;­DB01232)	0.292(CHEMBL3988903) 0.284(CHEMBL3706528;­DBMET01549;­DBMET01550) 0.281(CHEMBL3706529;­DBMET01548 )
Carbonic anhydrase V inhibitor	0.931(DB00273) 0.746(CHEMBL902;­DB00927) 0.696(DB00869)	0.906(DBMET02909;­DBMET02910) 0.680(DBMET00565;­DBMET00573;­DBMET02448;­DBMET02449;­METXBIODB02238) 0.612(CHEMBL1208633 )
Glucose-dependent insulinotropic receptor antagonist	0.154(DB01189) 0.014(METXBIODB01438;­METXBIODB01440) 0.011(DB01591)	0.014(DBMET00493) 0.013(DBMET02021) 0.009(CHEMBL380905 )
GABA A receptor agonist	0.991(METXBIODB01490) 0.742(DB05087) 0.427(DB01215)	0.960(METXBIODB01491) 0.830(METXBIODB01492) 0.446(DBMET03442 )
Imidazoline I2 receptor antagonist	0.399(DB04948) 0.072(DB00575) 0.040(DB00592;­METXBIODB01620)	0.052(METXBIODB00725) 0.038(CHEMBL4525123;­CHEMBL4525124) 0.028(DBMET01195;­METXBIODB00605 )
Protein kinase C beta inhibitor	0.970(DB06595) 0.419(METXBIODB01288) 0.182(DB00458;­METXBIODB00907;­METXBIODB01158)	0.986(DBMET01440) 0.973(DBMET01441) 0.372(METXBIODB01289 )
Benzodiazepine inverse agonist	0.639(METXBIODB01490) 0.133(METXBIODB00858) 0.096(DB00683;­METXBIODB01040)	0.620(METXBIODB01492) 0.554(METXBIODB01491) 0.242(METXBIODB00936 )
Melanocortin agonist	0.097(METXBIODB01173) 0.079(DB09059) 0.074(DB11296)	0.621(DBMET00840) 0.143(DBMET02067) 0.126(DBMET00502 )
Nerve growth factor antagonist	0.120(METXBIODB00178) 0.113(DB00627) 0.106(DB00836)	0.100(DBMET00103;­METXBIODB00518) 0.097(DBMET01697) 0.095(METXBIODB00180 )
Phosphodiesterase 6B inhibitor	0.990(DB00862) 0.564(DB00820) 0.248(METXBIODB00471)	0.990(DBMET03640) 0.564(DBMET03416) 0.504(DBMET00326 )
Glutaminyl-peptide cyclotransferase inhibitor	0.081(DB00501) 0.047(METXBIODB00176) 0.043(METXBIODB02630)	0.081(DBMET03242;­DBMET03243) 0.046(METXBIODB00534) 0.040(DBMET02770 )
Adenosine A2a receptor antagonist	0.899(DB00640) 0.878(DB00631) 0.845(DB01280)	0.974(CHEMBL3526900) 0.641(DBMET00496) 0.584(METXBIODB00045 )
Prostaglandin EP3 antagonist	0.576(DB00770) 0.489(DB00929) 0.475(DB00905)	0.619(DB00917) 0.576(DBMET02086) 0.559(DBMET02588 )
Neutrophil collagenase inhibitor	0.171(DB06151) 0.156(DB02546) 0.153(CHEMBL498;­DB00672)	0.310(CHEMBL3544779) 0.257(DBMET02066) 0.252(DBMET01045 )
MAP3K5 inhibitor	0.089(DB06595) 0.076(METXBIODB02345) 0.064(METXBIODB02438)	0.089(DBMET01441) 0.077(DBMET02824) 0.068(METXBIODB02346 )
Xanthine dehydrogenase inhibitor	0.510(DB04854) 0.488(METXBIODB02196) 0.478(DB01685;­METXBIODB02526)	0.585(DBMET01498) 0.454(CHEMBL3544765) 0.406(CHEMBL75589 )
Fructose-1,6-bisphosphatase 1 inhibitor	0.180(DB14126) 0.131(CHEMBL498;­DB00672) 0.130(DB00530;­METXBIODB01718)	0.252(DBMET01173;­METXBIODB01188) 0.180(DBMET01425) 0.130(DBMET01790 )
Acetyl-CoA transferase 2 inhibitor	0.142(METXBIODB01434) 0.137(METXBIODB00513) 0.136(METXBIODB00891)	0.219(METXBIODB03140) 0.185(METXBIODB01204) 0.165(METXBIODB00453 )
DNA methyltransferase I inhibitor	0.764(DB00242) 0.718(DB00640) 0.698(DB01262)	0.925(DBMET00514) 0.739(METXBIODB02167) 0.728(METXBIODB02169 )
CXC chemokine 2 receptor antagonist	0.112(CHEMBL1076347) 0.079(METXBIODB02509) 0.063(METXBIODB02754)	0.240(CHEMBL3527500;­CHEMBL3527578) 0.128(CHEMBL3527579) 0.091(METXBIODB00193 )
Cytotoxic	0.925(CHEMBL92;­DB01248) 0.916(DB06772) 0.909(CHEMBL1783834)	0.952(METXBIODB02105) 0.941(DBMET03414) 0.938(DBMET03415 )
5 Hydroxytryptamine 3A antagonist	0.663(DB00889;­METXBIODB00874) 0.622(METXBIODB01508) 0.443(CHEMBL715;­DB00334;­METXBIODB01125)	0.455(DBMET00406;­METXBIODB00876) 0.451(METXBIODB01511) 0.381(CHEMBL1125;­DBMET00265 )
NAD(P)H dehydrogenase (quinone) inhibitor	0.900(DB01418) 0.855(METXBIODB02161) 0.825(METXBIODB02163)	0.915(DBMET00037) 0.906(DBMET00038) 0.904(DBMET01042;­METXBIODB01584;­METXBIODB01585;­METXBIODB01587;­METXBIODB01588 )
Inducible nitric-oxide synthase inhibitor	0.420(METXBIODB02871) 0.408(DB00121) 0.398(DB00129)	0.689(DBMET00502) 0.539(DBMET03073) 0.504(DBMET00486 )
Carbonic anhydrase II stimulant	0.873(DB00273) 0.242(DB01124) 0.220(CHEMBL498;­DB00672)	0.844(DBMET02909;­DBMET02910) 0.798(DBMET02911) 0.194(DBMET00289 )
Antihyperaldosteronism	0.887(CHEMBL1393;­DB00421) 0.654(DB01395) 0.619(DB16165)	0.829(CHEMBL3544705;­DBMET02483) 0.663(CHEMBL3638292) 0.617(DBMET02484;­DBMET02485 )
Histamine H1 receptor antagonist	0.910(DB01084) 0.849(DB00455) 0.808(DB11742)	0.792(DBMET00391) 0.773(METXBIODB00572) 0.757(DBMET00752;­DBMET00761 )
Antibiotic Anthracycline-like	0.966(METXBIODB02104) 0.921(CHEMBL417;­CHEMBL53463;­DB00997) 0.867(CHEMBL178;­DB00694)	0.969(CHEMBL3508145) 0.960(CHEMBL3508142) 0.896(CHEMBL3508141;­CHEMBL3508146;­DBMET00647 )
CD45 antagonist	0.472(CHEMBL898) 0.435(DB00244) 0.394(METXBIODB01301)	0.670(DBMET01120) 0.627(DBMET01119) 0.619(DBMET01121 )
Growth hormone releasing factor antagonist	0.101(DB09059) 0.038(DB11296) 0.033(DB01255)	0.063(DBMET02067) 0.055(DBMET00506) 0.043(DBMET02065 )
Calpain 1 inhibitor	0.060(DB14187) 0.047(DB01914;­DB05521;­DB09419;­DB11735) 0.044(DB00121)	0.678(DB00166) 0.531(METXBIODB00859) 0.206(METXBIODB00825 )
Neuropeptide Y antagonist	0.397(DB06016) 0.354(METXBIODB00330) 0.345(METXBIODB01183)	0.396(DBMET03492) 0.391(DBMET03491) 0.221(DBMET01778 )
11-Beta-hydroxysteroid dehydrogenase 2 inhibitor	0.938(DB13751) 0.778(METXBIODB02993) 0.666(DB00378)	0.944(DBMET02110) 0.635(METXBIODB02994) 0.599(DBMET00286;­METXBIODB01194 )
Metabolic disease treatment	0.863(DB12713) 0.810(METXBIODB02278) 0.800(DB01586;­METXBIODB00939)	0.819(METXBIODB01505) 0.810(METXBIODB00941) 0.804(DB00166 )
Urate transporter 1 inhibitor	0.515(DB04854) 0.252(METXBIODB02564) 0.228(DB00795)	0.514(DBMET03281) 0.432(DBMET00303) 0.296(DBMET03279 )
Beta adrenoreceptor antagonist	0.855(DB00983) 0.807(DB00264;­METXBIODB00121) 0.792(DB00373;­METXBIODB01469)	0.867(DBMET00319;­METXBIODB00122) 0.857(DBMET02956) 0.792(DBMET00740 )
Benzodiazepine receptor peripheral-type antagonist	0.717(DB00425) 0.232(DB00842) 0.228(DB00186)	0.477(DBMET01242) 0.473(DBMET01241) 0.468(DBMET01238 )
5 Hydroxytryptamine 1A antagonist	0.965(DB13345) 0.958(DB08922;­METXBIODB02106) 0.927(DB08815)	0.965(METXBIODB02107) 0.925(DBMET02984) 0.774(DBMET01502;­METXBIODB02109 )
Protease activated receptor 1 antagonist	0.822(CHEMBL493982;­DB09030) 0.163(METXBIODB01173) 0.135(DB01018)	0.864(CHEMBL498785;­DBMET01376) 0.811(DBMET01375) 0.799(CHEMBL3542381 )
GP IIb/IIIa receptor antagonist	0.331(CHEMBL1430) 0.296(CHEMBL1046;­DB00513) 0.286(CHEMBL169901;­DB04840)	0.624(CHEMBL65267) 0.616(DBMET00502) 0.477(DBMET01535 )
5 Hydroxytryptamine 1B antagonist	0.991(DB13345) 0.935(METXBIODB01680) 0.814(DB00315)	0.934(METXBIODB01682) 0.737(DBMET01792) 0.646(METXBIODB00959 )
Mediator release inhibitor	0.757(CHEMBL3527416) 0.681(DB00768) 0.666(DB11217)	0.877(DBMET00879;­DBMET00881;­METXBIODB02996) 0.838(CHEMBL3526994) 0.825(CHEMBL3526996 )
Progesterone receptor B antagonist	0.107(METXBIODB01134) 0.104(DB00834) 0.095(METXBIODB01044)	0.170(DBMET02237) 0.100(METXBIODB02005) 0.098(DBMET00695 )
Prostaglandin EP1 antagonist	0.619(DB00770) 0.539(DB00905) 0.490(DB00287)	0.654(DB00917) 0.653(DBMET02588) 0.619(DBMET02086 )
Alpha 2c adrenoreceptor agonist	0.765(DB00484) 0.740(DB00697;­METXBIODB02082) 0.709(DB04948)	0.203(DBMET00464) 0.132(DBMET00465) 0.126(DBMET00468 )
RNA-directed RNA polymerase inhibitor	0.962(DB08934) 0.122(METXBIODB02233) 0.113(METXBIODB02370)	0.919(DBMET01381) 0.885(DBMET01383) 0.841(DBMET01382 )
Angiogenesis stimulant	0.888(CHEMBL3542194) 0.877(DB06697) 0.867(METXBIODB00454)	0.915(DBMET03082) 0.892(DBMET00509) 0.889(CHEMBL3542195 )
Ceramide glucosyltransferase inhibitor	0.597(DB09039) 0.148(CHEMBL3527223) 0.101(CHEMBL417;­CHEMBL53463;­DB00997)	0.413(DBMET03450;­DBMET03451;­DBMET03454) 0.326(DBMET03455) 0.303(DBMET03453 )
Potassium channel (Inward rectifier) blocker	0.510(DB00448;­DB05351;­METXBIODB01955) 0.475(METXBIODB01973) 0.472(CHEMBL1503;­DB00338;­DB00736;­METXBIODB00771)	0.445(DBMET01494;­METXBIODB01957) 0.424(DBMET00186;­DBMET01657;­METXBIODB00774) 0.405(DBMET01822 )
Somatostatin 2 antagonist	0.332(DB09059) 0.128(DB06176) 0.122(DB00129)	0.955(DBMET03190) 0.244(DBMET02662) 0.204(DB11100 )
Tryptase inhibitor	0.454(CHEMBL169901;­DB04840) 0.306(METXBIODB01173) 0.115(DB00711)	0.421(CHEMBL3638292) 0.387(DBMET03118) 0.331(CHEMBL1710849;­DBMET01641 )
Acetylcholine M3 receptor agonist	0.983(DB00185;­METXBIODB00507) 0.492(DB01085;­METXBIODB01181) 0.336(DB06756)	0.983(DBMET00430;­DBMET00431;­DBMET00433) 0.943(METXBIODB00508) 0.310(DBMET01973 )
Glutamate (mGluR group I) agonist	0.189(CHEMBL1140;­DB05016;­DB12184;­METXBIODB00870) 0.156(METXBIODB00647) 0.142(DB01058)	0.189(DBMET02629) 0.156(CHEMBL578211;­DBMET00519) 0.134(DBMET03758 )
Factor XIIIa inhibitor	0.112(DB01255) 0.105(DB13747;­METXBIODB00715) 0.092(DB00129)	0.191(CHEMBL3544622) 0.159(CHEMBL3544721) 0.156(CHEMBL3544600 )
Leukotriene D4 antagonist	0.947(CHEMBL787;­DB00471) 0.716(METXBIODB02380) 0.235(METXBIODB02970)	0.945(CHEMBL3526241;­DBMET01246;­DBMET01247;­DBMET01707;­DBMET01708) 0.917(CHEMBL3526240) 0.912(CHEMBL3526481;­DBMET01248;­DBMET01249;­DBMET01709 )
Neurotensin receptor antagonist	0.286(DB00129) 0.248(DB01255) 0.199(CHEMBL169901;­DB04840)	0.465(CHEMBL3526373) 0.300(DBMET00502) 0.287(DB00123;­DBMET02067 )
Dyspepsia treatment	0.803(DB09089) 0.689(DB06480) 0.613(DB11739)	0.808(DBMET01505) 0.738(DBMET02203) 0.653(DBMET02197 )
Nicotinic receptor alpha7 subunit antagonist	0.691(CHEMBL3;­DB00184;­METXBIODB02230) 0.639(METXBIODB01508) 0.554(DB01591)	0.563(DBMET00840) 0.554(CHEMBL6200;­DBMET00520) 0.488(METXBIODB01511 )
Adenosine A2 receptor antagonist	0.891(DB00640) 0.861(DB01280) 0.839(DB00631)	0.972(CHEMBL3526900) 0.696(DBMET00496) 0.672(METXBIODB00857 )
Transcription factor inhibitor	0.713(DB00507) 0.696(DB01247) 0.676(DB00614)	0.944(CHEMBL3527192) 0.913(CHEMBL3544771) 0.736(DBMET01012 )
Cyclin T1 inhibitor	0.045(METXBIODB02408) 0.041(METXBIODB00379) 0.036(METXBIODB02132)	0.062(METXBIODB00380) 0.053(DBMET01894) 0.048(CHEMBL276521 )
Cholinergic	0.996(DB00185;­METXBIODB00507) 0.963(DB00382) 0.944(METXBIODB01434)	0.996(DBMET00430;­DBMET00431;­DBMET00433;­METXBIODB00508) 0.946(METXBIODB01435) 0.912(DBMET01757 )
Cyclophilin A inhibitor	0.655(CHEMBL160;­DB00091) 0.582(METXBIODB00667) 0.522(METXBIODB01566)	0.693(CHEMBL2407584;­CHEMBL3544881;­CHEMBL3544883;­DBMET02217) 0.679(CHEMBL3544882;­CHEMBL3544884) 0.638(CHEMBL3544879 )
Glutamate (mGluR5) agonist	0.157(DB12184;­METXBIODB00870) 0.142(METXBIODB00647) 0.135(DB05016)	0.142(CHEMBL578211;­DBMET00519) 0.120(DBMET03758) 0.113(CHEMBL3706522 )
Histone deacetylase SIRT1 inhibitor	0.692(METXBIODB01930) 0.409(CHEMBL1140) 0.329(DB00129;­DB01255)	0.694(METXBIODB00240) 0.571(METXBIODB00304) 0.461(DBMET02067 )
Corticosteroid-like	0.981(CHEMBL1473;­DB00588) 0.974(DB08906) 0.973(DB00764)	0.973(DBMET02361) 0.958(DBMET02573) 0.954(DBMET00450 )
Integrin beta3 antagonist	0.169(METXBIODB01514) 0.142(CHEMBL1046;­DB00513) 0.125(DB00575)	0.438(DBMET00502) 0.383(DBMET01477) 0.325(CHEMBL1157;­DBMET00501 )
Potassium channel Kv1.3 blocker	0.453(METXBIODB00452) 0.369(METXBIODB01034) 0.283(METXBIODB01203)	0.195(DBMET01615) 0.188(DBMET00132;­METXBIODB00430;­METXBIODB01670) 0.185(METXBIODB00313 )
Monophenol monooxygenase inhibitor	0.960(METXBIODB03141) 0.952(CHEMBL3527416) 0.948(DB09298)	0.986(CHEMBL3526295) 0.977(CHEMBL3526454) 0.976(METXBIODB02188;­METXBIODB02189 )
Antibiotic Quinolone-like	0.761(DB01155) 0.639(DB01044) 0.580(DB00685;­METXBIODB02642)	0.650(DBMET02516) 0.503(DBMET03009) 0.437(CHEMBL3544746 )
Beta 1 adrenoreceptor agonist	0.783(DB00938;­METXBIODB01303) 0.768(DB09080) 0.766(DB09082)	0.791(DBMET02956) 0.582(DBMET01394) 0.443(DBMET00386;­METXBIODB01304 )
Alkylator	0.969(METXBIODB03049) 0.955(DB05109) 0.937(DB00385)	0.977(DBMET01100) 0.969(DBMET00024;­METXBIODB00966) 0.959(CHEMBL3706539 )
Antiacne	0.996(DB09096) 0.992(METXBIODB03098) 0.979(DB06755)	0.969(DBMET00454) 0.967(DB00523;­DBMET01736;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.956(METXBIODB03099 )
5 Hydroxytryptamine 3B antagonist	0.974(METXBIODB01085) 0.735(METXBIODB01508) 0.637(DB06148;­METXBIODB01228;­METXBIODB01848)	0.593(METXBIODB01086) 0.527(CHEMBL4525085) 0.488(DBMET02203 )
Cathepsin E inhibitor	0.186(METXBIODB01177) 0.183(CHEMBL16;­DB00252) 0.143(METXBIODB01179;­METXBIODB01881)	0.183(DBMET01170) 0.146(DBMET02066) 0.145(CHEMBL3507703;­DBMET03216 )
Urotensin II agonist	0.086(DB09031) 0.063(DB00129;­DB00924) 0.061(DB00215;­DB01175)	0.119(CHEMBL4525771) 0.084(DBMET03073) 0.072(DBMET03072 )
Dopamine uptake inhibitor	0.931(DB00907;­METXBIODB00058) 0.811(DB00245) 0.770(DB01104)	0.861(METXBIODB00059) 0.855(DBMET00645) 0.783(METXBIODB01570 )
Carbonic anhydrase I inhibitor	0.691(DB00273) 0.522(DB00869) 0.410(METXBIODB02492)	0.529(DBMET02909;­DBMET02910) 0.483(DBMET03010) 0.434(DBMET00729 )
Free radical scavenger	0.921(METXBIODB02879) 0.910(METXBIODB02136) 0.906(METXBIODB01399)	0.923(CHEMBL3544744) 0.918(DBMET03074) 0.913(METXBIODB02880 )
Interleukin 1 beta converting enzyme inhibitor	0.231(DB09292) 0.182(DB06819) 0.179(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450)	0.274(CHEMBL3544766) 0.217(CHEMBL3526309) 0.215(DBMET01401 )
Geranylgeranyltransferase inhibitor	0.125(CHEMBL104) 0.087(METXBIODB02568;­METXBIODB02799) 0.085(DB11296)	0.113(DBMET00508) 0.092(DBMET00503) 0.085(DBMET00506 )
Potassium channel small-conductance Ca-activated blocker	0.391(METXBIODB00008) 0.211(CHEMBL42;­DB00363;­METXBIODB00638) 0.175(DB13941)	0.514(DB06457) 0.428(DBMET00636) 0.211(CHEMBL4525085 )
Carbonic anhydrase IV stimulant	0.130(DB01124) 0.122(CHEMBL498;­DB00672) 0.096(DB11296)	0.103(DBMET00289) 0.093(CHEMBL3544714) 0.089(CHEMBL3544715 )
Bombesin 3 receptor agonist	0.145(DB00214) 0.121(METXBIODB01623) 0.112(DB01685;­METXBIODB02526)	0.153(METXBIODB01626) 0.130(DBMET02233) 0.129(DBMET02232 )
5 Hydroxytryptamine 7 agonist	0.521(DB01238) 0.470(METXBIODB01089) 0.416(METXBIODB00287)	0.416(DBMET01359) 0.353(DBMET02464) 0.343(DBMET01362 )
CC chemokine 5 receptor antagonist	0.755(DB06652) 0.269(DB00629) 0.196(DB01058)	0.894(DBMET00081) 0.883(DBMET00083) 0.874(DBMET00080 )
Endothelin-converting enzyme inhibitor	0.402(CHEMBL1314;­DB06823) 0.350(DB06151) 0.298(DB01197)	0.455(DBMET03082) 0.415(CHEMBL2158192;­DBMET01416) 0.383(DBMET00503 )
Plasmepsin I inhibitor	0.401(DB00742;­DB11195) 0.115(DB01914;­DB09419;­DB11735) 0.090(METXBIODB00073;­METXBIODB01835)	0.090(CHEMBL3706536) 0.081(CHEMBL3091852) 0.072(CHEMBL3706523 )
Tryptophan 5 hydroxylase inhibitor	0.915(DB12095) 0.120(DB01235) 0.107(DB13848)	0.978(DBMET03552) 0.366(DBMET03553) 0.349(DBMET03554 )
Vasopressin 1A agonist	0.389(DB09059) 0.075(METXBIODB02451) 0.048(DB00949)	0.075(DBMET00862) 0.072(DBMET02067) 0.061(METXBIODB00805 )
Platelet adhesion inhibitor	0.904(CHEMBL1201772;­DB06209) 0.889(METXBIODB01752) 0.833(METXBIODB01307)	0.901(DBMET00483) 0.898(DBMET01163) 0.897(DBMET00099;­METXBIODB01308 )
Toll-Like receptor antagonist	0.765(DB00704) 0.750(DB01183;­DB01192) 0.723(DB00497;­METXBIODB01139)	0.750(DBMET00321;­METXBIODB01140) 0.617(METXBIODB00894) 0.564(DBMET00179;­METXBIODB01969 )
Kainate receptor 5 antagonist	0.280(CHEMBL445990) 0.262(METXBIODB02370) 0.257(METXBIODB02368)	0.252(METXBIODB00919) 0.251(DBMET00993) 0.233(DBMET00494 )
Nociceptin (N/OFQ) receptor agonist	0.580(DB00921) 0.572(METXBIODB01912) 0.275(METXBIODB01170)	0.572(DBMET00174) 0.265(DBMET00176) 0.254(METXBIODB02676 )
5 Hydroxytryptamine 3 agonist	0.491(DB01084) 0.359(METXBIODB02400) 0.335(CHEMBL2104993;­DB09068)	0.400(DBMET00752;­DBMET00761) 0.325(DBMET01778) 0.314(CHEMBL4525085 )
Carbonic anhydrase XIII inhibitor	0.990(DB00273) 0.940(DB01194) 0.938(CHEMBL902;­DB00927)	0.988(DBMET02909;­DBMET02910) 0.859(CHEMBL3526295) 0.855(CHEMBL3526944 )
Parathyroid hormone antagonist	0.799(METXBIODB02719) 0.750(CHEMBL846;­DB00136) 0.559(DB00153;­METXBIODB01575;­METXBIODB02762)	0.881(DBMET02435) 0.799(DBMET02434) 0.697(CHEMBL3542380;­CHEMBL3542386 )
Acetylcholine nicotinic antagonist	0.824(DB11421) 0.787(METXBIODB00904) 0.766(METXBIODB01541)	0.787(DBMET00840) 0.711(METXBIODB01542) 0.663(CHEMBL6200;­DBMET00520 )
Phosphoglycerate kinase inhibitor	0.623(DB00640) 0.535(DB01280) 0.488(DB00441)	0.993(DB00171) 0.971(DBMET00485;­DBMET03265) 0.710(CHEMBL3638285 )
Protease activated receptor agonist	0.036(METXBIODB01173) 0.021(DB01255) 0.010(DB00130)	0.131(DBMET02067) 0.072(DBMET00502) 0.039(DB03091 )
5 Hydroxytryptamine 2B antagonist	0.995(DB13345) 0.938(METXBIODB00369) 0.935(METXBIODB00475)	0.994(DBMET02090) 0.971(METXBIODB00370) 0.970(METXBIODB00476 )
5-Lipoxygenase inhibitor	0.981(DB00744) 0.921(METXBIODB00064) 0.839(METXBIODB00328)	0.896(DBMET00138;­METXBIODB00066) 0.860(DBMET00139;­METXBIODB00065) 0.831(METXBIODB00329 )
Antiviral (Hepatitis C)	0.977(DB11586) 0.916(DB08934) 0.884(CHEMBL1076930)	0.971(DBMET02051) 0.963(DBMET02050) 0.909(DBMET01381 )
Heat shock protein 90 beta antagonist	0.989(CHEMBL383824) 0.300(CHEMBL467399) 0.225(DB02513;­METXBIODB02078)	0.942(CHEMBL3526785) 0.941(CHEMBL3526786) 0.838(CHEMBL3526783 )
Adenylate cyclase inhibitor	0.764(DB00242) 0.731(DB00640) 0.695(DB09299)	0.955(DBMET00677) 0.866(DB00171) 0.833(CHEMBL3526610 )
Peroxisome proliferator-activated receptor delta antagonist	0.746(METXBIODB02575) 0.383(CHEMBL672;­DB01039) 0.246(METXBIODB01209)	0.654(CHEMBL981;­DB13873) 0.438(CHEMBL2106581;­DBMET02798) 0.435(METXBIODB00805 )
Beta adrenoreceptor agonist	0.808(DB00938;­METXBIODB01303) 0.766(DB00983) 0.750(DB09082)	0.862(DBMET02956) 0.682(DBMET01394) 0.681(DBMET00386;­METXBIODB01304 )
Bombesin agonist	0.168(DB00214) 0.144(METXBIODB01623) 0.133(DB01685;­METXBIODB02526)	0.181(METXBIODB01626) 0.152(DBMET02232;­DBMET02233) 0.151(DBMET02231 )
Elastase 2A inhibitor	0.120(DB01606) 0.092(METXBIODB00658) 0.086(METXBIODB02974)	0.101(DBMET00758) 0.093(METXBIODB00659) 0.063(DBMET03001 )
Elastase 2 inhibitor	0.120(DB01606) 0.092(METXBIODB00658) 0.086(METXBIODB02974)	0.101(DBMET00758) 0.093(METXBIODB00659) 0.063(DBMET03001 )
Melanocortin 3 agonist	0.076(DB11296) 0.074(METXBIODB01173) 0.064(DB01202)	0.572(DBMET00840) 0.096(DBMET00502) 0.069(DBMET01483 )
Histone deacetylase 4 inhibitor	0.664(METXBIODB02294) 0.641(DB02546) 0.529(DB05015)	0.989(CHEMBL3526395) 0.985(CHEMBL3526396) 0.983(CHEMBL3526397 )
Integrin alpha2beta1 antagonist	0.179(DB03088) 0.059(CHEMBL1076347) 0.056(DB13269)	0.134(DBMET00494) 0.101(CHEMBL3544779) 0.062(DBMET03556 )
Acetylcholine M2 receptor agonist	0.841(DB00185;­METXBIODB00507) 0.470(METXBIODB01383) 0.360(METXBIODB01623)	0.841(DBMET00430;­DBMET00431;­DBMET00433) 0.752(METXBIODB00508) 0.364(METXBIODB01624 )
11-Beta-hydroxysteroid dehydrogenase 1 inhibitor	0.487(CHEMBL385517;­DB06335) 0.441(DB04876) 0.385(DB01043)	0.607(DBMET03320) 0.556(CHEMBL3350936;­DBMET00459) 0.525(CHEMBL3542408 )
Bromodomain-containing protein 2 inhibitor	0.271(CHEMBL661;­DB00404) 0.214(DB00897) 0.202(METXBIODB00041)	0.207(DBMET02821) 0.194(DBMET01944) 0.182(CHEMBL1313;­DBMET00348 )
Alpha 2d adrenoreceptor agonist	0.691(METXBIODB02856) 0.508(DB00484) 0.397(DB00763)	0.423(DBMET00464) 0.406(DBMET00465) 0.387(CHEMBL4525123;­CHEMBL4525124 )
Calcineurin inhibitor	0.854(CHEMBL160;­DB00091) 0.737(CHEMBL269732;­DB00864;­METXBIODB00828) 0.598(METXBIODB00667)	0.828(CHEMBL3544879) 0.819(CHEMBL3544638) 0.784(CHEMBL2407580;­DBMET00359 )
Growth factor receptor-bound protein 2 antagonist	0.050(METXBIODB00896) 0.049(DB06716) 0.044(DB00130)	0.223(METXBIODB01152) 0.186(METXBIODB00593) 0.083(DBMET01816 )
Neuronal nicotinic receptor antagonist	0.838(DB11421) 0.796(METXBIODB00904) 0.741(METXBIODB01541)	0.807(DBMET00840) 0.678(CHEMBL6200;­DBMET00520) 0.654(CHEMBL3526370 )
Melanocortin 5 agonist	0.108(METXBIODB02611) 0.106(DB11296) 0.089(METXBIODB01173)	0.729(DBMET00840) 0.128(DBMET00502) 0.120(DBMET01483 )
Somatostatin 5 antagonist	0.289(DB09059) 0.113(DB06176) 0.102(CHEMBL160;­DB00091)	0.430(DBMET03190) 0.220(DBMET02662) 0.142(DB00166 )
Glutathione S-transferase inhibitor	0.410(DB14001) 0.349(DB14002) 0.305(METXBIODB02420)	0.579(CHEMBL3544870) 0.551(CHEMBL3706541) 0.550(CHEMBL3988901 )
Sleep apnea treatment	0.467(DB09034) 0.315(CHEMBL1373;­DB00745) 0.298(DB00909)	0.304(DBMET00335) 0.269(DB06777) 0.230(METXBIODB00940 )
NMDA receptor antagonist	0.954(METXBIODB01959) 0.931(DB06741) 0.807(METXBIODB02244)	0.954(DBMET01818) 0.946(METXBIODB02241) 0.807(CHEMBL2105152;­DBMET01318 )
Cystic fibrosis treatment	0.988(CHEMBL532;­DB00199) 0.984(CHEMBL1741;­DB01211;­METXBIODB00619) 0.983(DB00778;­METXBIODB01286)	0.990(DBMET00944) 0.984(CHEMBL2063468;­DBMET01656) 0.982(CHEMBL3544830;­DBMET00356;­METXBIODB00620 )
Fructose-1,6-bisphosphatase inhibitor	0.314(DB00530) 0.306(METXBIODB01718) 0.247(DB14126)	0.319(DBMET01173;­METXBIODB01188) 0.306(DBMET01790) 0.247(DBMET01425 )
Alpha-glucosidase inhibitor	0.943(CHEMBL3527416) 0.940(METXBIODB03141) 0.873(CHEMBL3527223)	0.983(METXBIODB02135) 0.976(METXBIODB02134) 0.970(METXBIODB02880 )
NMDA 2 receptor antagonist	0.825(METXBIODB01496) 0.665(METXBIODB02244) 0.561(DB01043)	0.734(DBMET01320;­METXBIODB02246) 0.703(METXBIODB01497) 0.681(CHEMBL3527225;­CHEMBL3527226 )
Peroxisome proliferator-activated receptor gamma agonist	0.913(CHEMBL2104978) 0.905(CHEMBL186179;­METXBIODB01057) 0.850(METXBIODB02575)	0.918(CHEMBL3526971) 0.913(CHEMBL4525111;­CHEMBL4525112;­CHEMBL4525113;­CHEMBL4525114;­CHEMBL4525116;­CHEMBL4525117;­CHEMBL4525118) 0.910(CHEMBL254989;­METXBIODB01058 )
Vasopressin 1 agonist	0.395(DB09059) 0.041(DB06176) 0.036(METXBIODB02451)	0.711(CHEMBL1379) 0.057(DBMET02067) 0.040(CHEMBL1207;­CHEMBL3186899 )
Cholinergic antagonist	0.859(DB13345) 0.842(METXBIODB00475) 0.836(DB01062;­DB01591;­METXBIODB00150)	0.866(METXBIODB00477) 0.846(DBMET00746) 0.828(DBMET00430;­DBMET00431;­DBMET00433 )
5 Hydroxytryptamine 1 antagonist	0.981(DB13345) 0.925(DB08922;­METXBIODB02106) 0.918(METXBIODB01680)	0.937(METXBIODB02107) 0.917(DBMET02984) 0.900(METXBIODB01682 )
Complement factor 1 inhibitor	0.123(DB00250) 0.092(METXBIODB02449) 0.059(METXBIODB03012)	0.104(CHEMBL3526332) 0.059(DBMET01043) 0.030(DBMET00301 )
Acetylcholine antagonist	0.857(DB13345) 0.838(DB01591) 0.829(DB00185;­METXBIODB00507)	0.847(DBMET00746) 0.829(DBMET00430;­DBMET00431;­DBMET00433) 0.776(DBMET00381;­METXBIODB00153 )
Elastase inhibitor	0.220(DB01606) 0.213(CHEMBL1201772;­DB06209) 0.203(DB01139)	0.441(CHEMBL3527031;­DBMET00096) 0.376(DBMET02761) 0.207(METXBIODB01385;­METXBIODB02254 )
p53 inhibitor	0.393(CHEMBL696) 0.335(METXBIODB00050) 0.109(METXBIODB01859)	0.521(CHEMBL3544833) 0.281(CHEMBL3544798) 0.146(DBMET02789 )
Carbonic anhydrase II inhibitor	0.860(DB00273) 0.858(DB00869) 0.736(DB01194)	0.828(DBMET03010) 0.733(DBMET02909;­DBMET02910) 0.665(DBMET03671 )
Glycine transporter inhibitor	0.321(DB00215;­DB01175) 0.259(METXBIODB00691;­METXBIODB01530) 0.238(DB00472;­DB08472;­DB08544;­METXBIODB01953)	0.829(CHEMBL3526350) 0.580(CHEMBL3526349) 0.259(DBMET02781;­DBMET03704 )
Plasminogen activator inhibitor antagonist	0.783(DB00825;­METXBIODB01997;­METXBIODB02957) 0.255(DB03017;­METXBIODB01149;­METXBIODB01207;­METXBIODB01450) 0.241(METXBIODB01301)	0.525(METXBIODB03158) 0.379(CHEMBL1157;­DBMET00501) 0.349(DBMET01477 )
Antiviral (Coronavirus)	0.292(METXBIODB02190) 0.257(METXBIODB02183) 0.253(DB01094;­METXBIODB02187)	0.394(DB15686) 0.369(CHEMBL3527247) 0.327(METXBIODB03144 )
Antiviral (SARS coronavirus)	0.292(METXBIODB02190) 0.257(METXBIODB02183) 0.253(DB01094;­METXBIODB02187)	0.394(DB15686) 0.369(CHEMBL3527247) 0.327(METXBIODB03144 )
Glucokinase regulatory protein inhibitor	0.006(DB00250) 0.005(METXBIODB02333) 0.003(METXBIODB01439)	0.007(CHEMBL804;­DBMET00977) 0.006(CHEMBL574) 0.005(DB00891 )
AMP-activated protein kinase stimulant	0.874(CHEMBL1783834) 0.784(DB09038) 0.733(DB13751)	0.867(DBMET02142) 0.862(CHEMBL3542282;­CHEMBL3542283) 0.856(DBMET02143 )
Carbonic anhydrase VII inhibitor	0.907(DB00273) 0.644(DB01194) 0.589(DB00869)	0.823(DBMET02909;­DBMET02910) 0.507(DBMET01349) 0.493(CHEMBL3527060 )
Toll-Like receptor 4 antagonist	0.671(DB00704;­DB01183) 0.665(DB01192) 0.619(DB00497;­METXBIODB01139)	0.665(DBMET00321;­METXBIODB01140) 0.624(DBMET00424) 0.580(DBMET00342;­METXBIODB01141 )
Phosphodiesterase 6A inhibitor	0.993(DB00862) 0.337(DB00820) 0.215(METXBIODB01526)	0.993(DBMET03640) 0.767(DBMET00326) 0.411(METXBIODB00489 )
CC chemokine 2 receptor antagonist	0.170(DB01171) 0.169(METXBIODB00552) 0.130(DB16217)	0.170(DBMET02153) 0.130(DBMET03652) 0.129(DBMET02568 )
Cathepsin K inhibitor	0.993(DB06670) 0.243(DB05521) 0.179(DB11763)	0.980(DBMET01475) 0.959(DBMET01472) 0.850(DBMET01473 )
Egl nine homolog 1 inhibitor	0.462(DB12255) 0.450(DB04847) 0.079(METXBIODB02739)	0.308(DBMET03433) 0.214(CHEMBL586) 0.185(DBMET02630 )
Amino-acid-polyamine-organocation (APC) transporter antagonist	0.522(DB06824) 0.090(CHEMBL1046;­DB00513) 0.088(DB00129)	0.279(METXBIODB01640) 0.209(DBMET02067) 0.160(DBMET01456 )
Potassium channel small-conductance Ca-activated activator	0.179(DB00740) 0.136(METXBIODB00192) 0.126(CHEMBL42;­DB00363;­METXBIODB00638)	0.126(CHEMBL4525085) 0.110(DBMET01613) 0.108(DBMET00535 )
Nociceptin (N/OFQ) receptor antagonist	0.680(DB00921) 0.630(METXBIODB01912) 0.544(METXBIODB00747)	0.794(CHEMBL3526374) 0.630(DBMET00174) 0.570(METXBIODB01184 )
Nucleoside transporters inhibitor	0.586(DB00640) 0.267(DB01280) 0.211(DB06234)	0.412(DBMET01160) 0.363(DBMET01159) 0.264(DBMET03427 )
Follicle-stimulating hormone agonist	0.168(CHEMBL49429) 0.073(DB00465) 0.060(DB01065)	0.172(CHEMBL3544832) 0.119(CHEMBL3706522) 0.095(DBMET01341 )
Melanocortin 1 agonist	0.164(METXBIODB01173) 0.113(DB11296) 0.077(DB09059)	0.659(DBMET00840) 0.208(DBMET00502) 0.141(DBMET02067 )
Egl nine homolog 3 inhibitor	0.214(DB12255) 0.041(DB04847) 0.034(DB00627;­DB03793;­DB11682;­METXBIODB02476)	0.133(CHEMBL3542352) 0.122(DBMET02630) 0.116(DBMET01879 )
5 Hydroxytryptamine antagonist	0.994(DB13345) 0.976(DB06077) 0.959(DB00246)	0.979(DBMET02984) 0.962(DBMET02090) 0.952(METXBIODB02107 )
Sodium/hydrogen exchanger 3 inhibitor	0.903(DB11761) 0.114(CHEMBL498;­DB00672) 0.087(METXBIODB00552)	0.164(METXBIODB00553) 0.148(CHEMBL3184360;­DBMET00201) 0.110(CHEMBL804;­DBMET00977 )
Alpha 2a adrenoreceptor antagonist	0.996(DB13345) 0.990(METXBIODB00475) 0.979(DB00248)	0.944(DBMET02090) 0.930(METXBIODB00477) 0.896(DBMET02603;­DBMET02604 )
Bombesin 1 receptor antagonist	0.294(DB00191) 0.130(CHEMBL104) 0.080(DB11296)	0.310(DBMET02229) 0.156(DB01365) 0.099(DBMET02228 )
Expectorant	0.997(DB00778;­METXBIODB01286) 0.996(CHEMBL532;­DB00199) 0.995(CHEMBL1741;­DB01211;­METXBIODB00619)	0.995(METXBIODB01287) 0.992(CHEMBL2063468;­DBMET01656) 0.991(CHEMBL2022715;­DBMET00357;­DBMET00944;­METXBIODB00621 )
Histidine decarboxylase inhibitor	0.722(DB11296) 0.688(METXBIODB02190) 0.674(METXBIODB02133)	0.844(DBMET00503) 0.843(DBMET01483) 0.704(DBMET00253 )
ICAM 1 antagonist	0.478(CHEMBL503;­DB00227;­METXBIODB01008) 0.150(CHEMBL1064;­DB00641;­METXBIODB01371) 0.072(METXBIODB02838)	0.289(CHEMBL3544685) 0.139(DBMET01699) 0.128(METXBIODB01010 )
MAP kinase kinase 9 inhibitor	0.649(DB08881) 0.191(DB11763) 0.159(DB01685;­METXBIODB02526)	0.300(DBMET03718) 0.262(DBMET03719) 0.258(DBMET01856 )
Thyroid hormone beta antagonist	0.723(DB09282) 0.703(CHEMBL633;­DB01118) 0.669(DB04831;­METXBIODB01466)	0.839(CHEMBL3544771) 0.794(DBMET02275) 0.784(CHEMBL3526986 )
Thyroid hormone antagonist	0.873(METXBIODB00720) 0.798(CHEMBL633;­DB01118) 0.785(DB11412)	0.905(DBMET02275) 0.861(CHEMBL3526986) 0.819(CHEMBL3544771 )
Thioredoxin reductase inhibitor	0.516(METXBIODB02687) 0.502(METXBIODB02699) 0.490(METXBIODB02733;­METXBIODB02772;­METXBIODB02922)	0.346(CHEMBL1201391;­DBMET00388) 0.325(CHEMBL3544664) 0.324(CHEMBL3544679 )
Topoisomerase II beta inhibitor	0.901(DB00773;­METXBIODB00808) 0.619(DB00537) 0.593(CHEMBL417;­CHEMBL53463;­DB00997)	0.927(DBMET00367;­DBMET01264;­METXBIODB00809) 0.863(DBMET01265) 0.782(DBMET00853 )
Steroid 17-alpha-hydroxylase/17,20 lyase inhibitor	0.984(DB05812) 0.838(DB02789;­METXBIODB01189) 0.790(DB01420)	0.799(METXBIODB01190) 0.735(DBMET02653) 0.716(METXBIODB01195 )
Carbonic anhydrase I stimulant	0.241(DB01124) 0.228(CHEMBL498;­DB00672) 0.210(DB11296)	0.204(DBMET00289) 0.189(CHEMBL3544714) 0.181(CHEMBL3544715 )
Chymotrypsin inhibitor	0.623(METXBIODB02420) 0.590(DB00188) 0.493(DB01438)	0.762(DBMET02761) 0.661(CHEMBL3526352) 0.552(METXBIODB01385 )
Aldose reductase substrate	0.996(DB01914;­DB09419;­DB11735) 0.968(DB00742;­DB11195) 0.952(CHEMBL16;­DB00252)	0.990(DBMET01476;­DBMET01478) 0.978(DBMET01651) 0.972(DBMET02013 )
Carbonic anhydrase XIV inhibitor	0.864(DB00273) 0.771(DB01194) 0.695(DB00869)	0.841(DBMET02909;­DBMET02910) 0.758(DBMET02911) 0.681(DBMET03671 )
Cholesterol ester transfer protein antagonist	0.087(METXBIODB02451) 0.082(METXBIODB02871) 0.077(DB08814)	0.122(DBMET03180) 0.112(DBMET03181) 0.100(DBMET00376 )
Estrogen antagonist	0.991(METXBIODB00549) 0.943(CHEMBL411) 0.891(METXBIODB02070)	0.962(METXBIODB00551) 0.955(CHEMBL50995;­DBMET02716) 0.919(METXBIODB00550 )
Antianemic	0.860(DB04847) 0.825(DB12255) 0.814(DB11596)	0.855(DBMET03433) 0.597(CHEMBL586) 0.588(CHEMBL3542352 )
Hexokinase inhibitor	0.733(DB00581) 0.670(DB11365) 0.550(DB11217)	0.877(DB00171) 0.802(DB01861;­DB03501) 0.755(DBMET00485;­DBMET03265 )
Carnitine palmitoyltransferase inhibitor	0.189(DB05016) 0.083(DB09031) 0.073(METXBIODB01944)	0.083(CHEMBL1105;­DBMET00764) 0.078(DBMET02986) 0.076(DBMET03557 )
KiSS-1 receptor agonist	0.024(METXBIODB01173) 0.006(DB12783) 0.000(DB00130)	0.011(CHEMBL3091852;­METXBIODB01174) 0.007(DBMET00502) 0.006(DBMET02067 )
Carbonic anhydrase inhibitor	0.941(DB00869) 0.901(DB00273;­DB01194) 0.534(METXBIODB02492)	0.900(DBMET03010) 0.823(DBMET03671) 0.802(DBMET02909;­DBMET02910 )
Complement factor D inhibitor	0.048(METXBIODB00039) 0.045(DB00564) 0.028(DB00339)	0.049(CHEMBL3527229) 0.043(DBMET02351;­DBMET02358) 0.033(METXBIODB00040 )
Progesterone agonist	0.931(DB14583) 0.862(DB04839) 0.815(METXBIODB01137)	0.895(DBMET02127) 0.817(DBMET02129;­DBMET02130) 0.805(DB09389 )
Hypogonadism treatment	0.462(DB13185) 0.341(DB08804) 0.325(DB00624;­METXBIODB02276)	0.579(DBMET01495) 0.531(DBMET01496) 0.411(DB13169 )
Human T-cell leukemia virus type I protease inhibitor	0.071(METXBIODB02347) 0.057(METXBIODB02349) 0.045(METXBIODB02353)	0.088(CHEMBL1237008) 0.081(DBMET02075) 0.071(DBMET00506 )
Carnitine palmitoyltransferase 1 inhibitor	0.172(DB05016) 0.076(DB09031) 0.074(METXBIODB01944)	0.081(CHEMBL1105;­DBMET00764) 0.078(DBMET02986) 0.074(DBMET01814;­DBMET03557 )
Protease activated receptor 1 agonist	0.013(DB01255;­METXBIODB01173) 0.004(DB00130) 0.002(DB00129)	0.027(DBMET00502) 0.019(DBMET02067) 0.018(DB03091 )
CC chemokine 6 receptor agonist	0.014(METXBIODB00935) 0.012(CHEMBL1140) 0.008(METXBIODB01093)	0.012(DBMET02629) 0.007(DBMET02982) 0.005(DBMET02816 )
Purinergic P2X3 antagonist	0.179(DB00973;­METXBIODB02285) 0.169(METXBIODB02562) 0.136(METXBIODB00925)	0.201(DBMET02116) 0.107(DBMET03497) 0.102(DBMET02275 )
Beta 3 adrenoreceptor agonist	0.551(CHEMBL2095212;­DB08893) 0.518(DB00983) 0.479(DB00938;­METXBIODB01303)	0.649(DBMET02956) 0.551(DBMET03330;­DBMET03331) 0.330(DBMET00118;­METXBIODB00131 )
Histone deacetylase class I inhibitor	0.963(CHEMBL483254) 0.944(DB06176) 0.830(DB02546)	0.891(CHEMBL3527527) 0.798(CHEMBL3526395) 0.760(DBMET01443 )
Guanylate cyclase 1 stimulant	0.773(DB15456) 0.368(DB06154) 0.179(DB00727)	0.773(DBMET03244;­DBMET03245) 0.181(DBMET02011) 0.179(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598 )
Retinoic acid beta receptor agonist	0.933(DB06755) 0.900(DB00755;­DB00982;­METXBIODB00937) 0.847(METXBIODB01691)	0.900(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.850(DBMET03633) 0.812(DBMET00453 )
Neutral endopeptidase inhibitor	0.802(CHEMBL1314;­DB06823) 0.463(DB01197) 0.368(DB06151)	0.705(CHEMBL2158192;­DBMET01416) 0.703(DBMET03082) 0.440(DBMET00503 )
Integrin beta2 antagonist	0.365(CHEMBL503;­DB00227;­METXBIODB01008) 0.074(DB00731) 0.071(CHEMBL1064;­DB00641;­METXBIODB01371)	0.179(CHEMBL3544685) 0.097(METXBIODB01010) 0.090(CHEMBL3544669;­DBMET01699 )
Estrone sulfatase inhibitor	0.317(DB00273) 0.285(DB04574) 0.231(METXBIODB00781)	0.311(DBMET00642) 0.285(DBMET00530) 0.279(DBMET02908 )
Phosphodiesterase IV inhibitor	0.907(DB01656) 0.858(METXBIODB01645) 0.839(METXBIODB01552)	0.963(DBMET00997) 0.866(METXBIODB01554) 0.803(METXBIODB01555;­METXBIODB01646 )
DNA methylase inhibitor	0.831(DB00242) 0.789(DB00640) 0.765(DB01262)	0.971(DBMET00514) 0.908(CHEMBL3526610) 0.787(DBMET00485;­DBMET03265 )
Wound healing agent	0.979(DB00727) 0.958(METXBIODB01177) 0.934(METXBIODB01179;­METXBIODB01881)	0.979(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.953(DB11100) 0.934(DBMET00888 )
Endothelial nitric-oxide synthase inhibitor	0.346(METXBIODB01173) 0.170(DB00129) 0.144(DB06698)	0.460(DBMET00502) 0.191(DBMET02708) 0.155(DBMET01778 )
Alpha 1b adrenoreceptor antagonist	0.890(DB13345) 0.771(DB00246) 0.750(DB06077)	0.844(DBMET02984) 0.813(METXBIODB02107) 0.759(DBMET02985 )
Tetracycline antiport transporter antagonist	0.154(DB01017) 0.002(METXBIODB00291) 0.000(DB13175;­DB13178;­METXBIODB02172)	0.142(DBMET03011) 0.111(DBMET03012) 0.063(DBMET03013 )
Aryl hydrocarbon receptor antagonist	0.316(METXBIODB00228) 0.269(METXBIODB00452) 0.263(METXBIODB01792)	0.178(CHEMBL442289) 0.175(CHEMBL3527009) 0.162(DBMET03650 )
5 Hydroxytryptamine 3 antagonist	0.892(METXBIODB01696) 0.881(DB00889;­METXBIODB00874) 0.855(METXBIODB01815)	0.792(DBMET02203) 0.718(DBMET00406;­METXBIODB00876) 0.704(METXBIODB01697 )
Alpha 1d adrenoreceptor antagonist	0.949(DB13345) 0.906(DB08922;­METXBIODB02106) 0.764(DB00490)	0.816(DBMET02984) 0.813(METXBIODB02107) 0.755(METXBIODB02108 )
Monocarboxylic acid transporter 1 inhibitor	0.066(METXBIODB02453) 0.065(METXBIODB02180) 0.045(METXBIODB02283)	0.081(DBMET02079) 0.077(CHEMBL117487;­CHEMBL3706510;­DBMET00065) 0.066(CHEMBL3706507;­DBMET01106 )
Monocarboxylic acid transporter inhibitor	0.066(METXBIODB02453) 0.065(METXBIODB02180) 0.045(METXBIODB02283)	0.081(DBMET02079) 0.077(CHEMBL117487;­CHEMBL3706510;­DBMET00065) 0.066(CHEMBL3706507;­DBMET01106 )
Histone deacetylase 2 inhibitor	0.968(DB02546) 0.797(DB05015) 0.719(CHEMBL483254)	0.994(CHEMBL3526395) 0.982(CHEMBL3526396) 0.977(CHEMBL3526397 )
CF transmembrane conductance regulator antagonist	0.086(METXBIODB02236) 0.083(DB05016) 0.076(METXBIODB02912)	0.129(METXBIODB00194) 0.105(DBMET02113) 0.086(METXBIODB00193 )
Aminopeptidase N inhibitor	0.234(DB02546) 0.200(DB00492) 0.176(DB06151)	0.621(CHEMBL3544531) 0.545(CHEMBL3526186) 0.283(CHEMBL3544532 )
Integrin alpha2 antagonist	0.170(DB03088) 0.076(CHEMBL1076347;­CHEMBL498;­DB00672) 0.068(DB13269;­METXBIODB01518)	0.180(DBMET00494) 0.175(DBMET00725) 0.113(CHEMBL3544779 )
Glutamate receptor agonist	0.470(DB05016) 0.395(METXBIODB02380) 0.379(METXBIODB02126)	0.578(DBMET01139) 0.514(DBMET03125) 0.510(DB14569 )
Antidiuretic hormone agonist	0.637(DB09059) 0.242(CHEMBL49429) 0.146(DB06176)	0.829(CHEMBL1379) 0.301(CHEMBL1207) 0.267(DBMET02067 )
Angiotensin-converting enzyme 2 inhibitor	0.658(CHEMBL1314;­DB06823) 0.391(DB01197) 0.353(DB01348)	0.536(CHEMBL3544769) 0.468(CHEMBL2158192;­DBMET01416) 0.412(DBMET01142 )
Somatostatin 5 agonist	0.316(DB06824) 0.166(DB09059) 0.157(DB01202)	0.125(DBMET02067) 0.124(DBMET01115) 0.122(METXBIODB01221 )
Interleukin 8 antagonist	0.995(CHEMBL532;­DB00199;­DB00778;­METXBIODB01286) 0.993(CHEMBL1741;­DB01211;­METXBIODB00619) 0.830(METXBIODB00769)	0.996(METXBIODB01287) 0.995(CHEMBL2022715;­CHEMBL2063468;­DBMET00357;­DBMET01656;­METXBIODB00621) 0.976(DBMET00828 )
Vasopressin 2 agonist	0.537(DB09059) 0.224(CHEMBL49429) 0.106(METXBIODB02451)	0.981(CHEMBL1379) 0.171(DBMET02067) 0.142(DBMET03689 )
Aminopeptidase microsomal inhibitor	0.253(DB02546) 0.219(DB00492) 0.196(DB06151)	0.638(CHEMBL3544531) 0.564(CHEMBL3526186) 0.304(CHEMBL3544532 )
Constipation treatment	0.900(METXBIODB01912) 0.898(DB00921) 0.880(DB00704)	0.900(DBMET00174) 0.894(DBMET02201) 0.871(DBMET00321;­METXBIODB01140 )
Calcium-sensing receptor agonist	0.338(DB01012) 0.255(METXBIODB01417) 0.109(DB00129)	0.400(DBMET01883) 0.136(METXBIODB01418) 0.094(DB00123;­DBMET02153 )
Microsomal triglyceride transfer protein inhibitor	0.133(METXBIODB00295) 0.070(CHEMBL455136) 0.048(DB01012)	0.070(CHEMBL4525144;­CHEMBL4525145;­CHEMBL4525146;­CHEMBL4525147;­CHEMBL4525148;­CHEMBL4525149;­CHEMBL4525150;­CHEMBL4525151;­CHEMBL4525152;­CHEMBL4525153;­CHEMBL4525154;­CHEMBL4525155;­CHEMBL4525156;­CHEMBL4525157;­CHEMBL4525158;­CHEMBL4525159) 0.058(CHEMBL3542269) 0.045(DBMET03080 )
Integrin beta5 antagonist	0.409(METXBIODB01514) 0.253(DB00575) 0.144(DB00181)	0.419(METXBIODB01515) 0.309(DBMET03118) 0.265(METXBIODB01516 )
Bombesin antagonist	0.218(DB00214;­DB11296) 0.077(DB00191) 0.062(DB00130;­METXBIODB02458)	0.175(DBMET02233) 0.165(DBMET02231) 0.152(DBMET02232 )
Nitric-oxide synthase inhibitor	0.488(DB00476) 0.474(METXBIODB01173) 0.417(METXBIODB01806)	0.674(DBMET00502) 0.458(DBMET00486) 0.424(DBMET03073 )
Kynurenine 3 monooxygenase inhibitor	0.253(DB00356) 0.142(METXBIODB02353) 0.126(METXBIODB02564)	0.398(DBMET00252) 0.302(DBMET01676) 0.281(DBMET00327 )
Methionyl aminopeptidase 2 inhibitor	0.124(METXBIODB02370) 0.102(CHEMBL686;­DB00784) 0.101(METXBIODB02368)	0.098(CHEMBL1203) 0.093(CHEMBL3544508;­DB02362;­DBMET00728;­DBMET01429) 0.092(DBMET00486 )
Estrogen receptor alpha agonist	0.751(METXBIODB00549) 0.590(CHEMBL691;­DB00977;­METXBIODB01784) 0.567(DB00783;­METXBIODB01814)	0.909(DBMET01207) 0.807(CHEMBL3638306;­DBMET03697) 0.676(METXBIODB00551 )
Transcription factor AP-1 inhibitor	0.568(DB06755) 0.531(DB00755;­DB00982;­METXBIODB00937) 0.504(DB00162;­METXBIODB01254)	0.558(METXBIODB00938) 0.531(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.504(DBMET02045 )
Calcium channel blocker	0.966(DB00622) 0.940(CHEMBL1726;­METXBIODB02119) 0.929(METXBIODB02115)	0.904(DBMET01832) 0.891(DBMET01833) 0.849(METXBIODB02122 )
Histone deacetylase inhibitor	0.962(CHEMBL483254) 0.960(DB06176) 0.872(DB05015)	0.893(CHEMBL3527527) 0.872(DBMET01443) 0.834(CHEMBL3526395 )
Neurokinin 2 agonist	0.123(DB01202) 0.119(DB01255) 0.089(DB01037)	0.434(DBMET00506) 0.288(DBMET02067) 0.121(DB03091 )
5 Hydroxytryptamine 2A antagonist	0.978(DB00734;­METXBIODB01274) 0.964(DB13345) 0.942(METXBIODB00923)	0.965(DBMET02984) 0.942(DBMET00323;­METXBIODB01276) 0.849(METXBIODB00924 )
CDC7 inhibitor	0.195(CHEMBL1140) 0.177(DB01685;­METXBIODB02526) 0.158(CHEMBL585;­DB00384)	0.251(CHEMBL226396) 0.212(DBMET03531) 0.195(CHEMBL3040018;­DBMET00025;­DBMET02629 )
Beta glucuronidase inhibitor	0.691(METXBIODB03141) 0.644(DB01094;­METXBIODB02187) 0.560(METXBIODB02190)	0.931(METXBIODB02188) 0.930(METXBIODB02189) 0.913(METXBIODB02191 )
Phosphodiesterase 4C inhibitor	0.742(DB00862) 0.644(DB01656) 0.530(METXBIODB01645)	0.759(DBMET00997) 0.754(DBMET03640) 0.493(METXBIODB00936 )
Transforming growth factor beta 2 antagonist	0.110(METXBIODB01020) 0.063(DB11793;­METXBIODB00935) 0.053(DB00339)	0.054(CHEMBL3706522) 0.053(METXBIODB01022) 0.051(DB13526 )
Dopamine D2 agonist	0.995(DB13345) 0.994(METXBIODB00475) 0.990(METXBIODB00369)	0.996(METXBIODB00275) 0.993(METXBIODB00477) 0.991(METXBIODB00476 )
Age-related macular degeneration treatment	0.538(DB06595) 0.524(DB06755) 0.428(METXBIODB02546)	0.614(DBMET02935;­METXBIODB00573) 0.467(DBMET01440) 0.465(DBMET01441 )
Acetylcholine nicotinic agonist	0.569(CHEMBL3;­DB00184;­METXBIODB02230) 0.478(METXBIODB01383) 0.399(DB01591)	0.672(DBMET00406;­METXBIODB00876) 0.585(CHEMBL6200;­DBMET00520) 0.307(CHEMBL578211;­DBMET00519 )
CC chemokine 4 receptor antagonist	0.236(CHEMBL64391;­DB01167;­METXBIODB00524) 0.146(DB01184) 0.145(CHEMBL104)	0.236(CHEMBL4525087;­CHEMBL4525088) 0.143(METXBIODB00526) 0.134(DBMET00374;­METXBIODB00525 )
Acetylcholinesterase inhibitor	0.984(DB00382) 0.975(METXBIODB01434) 0.903(METXBIODB00591)	0.976(METXBIODB01435) 0.945(DBMET01757) 0.922(DBMET01756 )
Histone deacetylase 3 inhibitor	0.960(DB02546) 0.781(METXBIODB02294) 0.731(DB06176)	0.994(CHEMBL3526395) 0.983(CHEMBL3526396) 0.979(CHEMBL3526397 )
Maillard reaction inhibitor	0.767(DB13853) 0.634(CHEMBL49563;­DB00163) 0.605(CHEMBL64;­METXBIODB02327)	0.803(DBMET02057) 0.664(CHEMBL527285;­DBMET02040;­DBMET02324) 0.620(CHEMBL1237008 )
Cyclin A inhibitor	0.906(DB09073) 0.391(DB11697) 0.314(DB00619)	0.890(DBMET02380) 0.837(DBMET02365) 0.791(DBMET02373 )
Thymidylate synthase inhibitor	0.549(CHEMBL34259) 0.490(DB00158) 0.395(DB00650)	0.526(DB00116) 0.505(CHEMBL886;­DBMET01999;­DBMET03585) 0.503(CHEMBL3544661 )
Autotaxin inhibitor	0.377(DB00356) 0.349(METXBIODB01151) 0.331(DB00779)	0.837(METXBIODB00722) 0.570(CHEMBL3526411) 0.532(DBMET00345 )
Stearoyl-CoA desaturase inhibitor	0.150(DB06201) 0.130(DB00656) 0.095(DB00398)	0.194(DB14569) 0.160(CHEMBL3526187) 0.146(DBMET03127 )
Cathepsin B inhibitor	0.955(DB06670) 0.300(DB05521) 0.229(METXBIODB00946)	0.997(METXBIODB00716) 0.954(DBMET01475) 0.908(DBMET01472 )
Potassium channel (ATP-sensitive) blocker	0.975(DB00448;­DB05351;­METXBIODB01955) 0.956(DB00213;­METXBIODB00543) 0.952(CHEMBL1503;­DB00338;­DB00736;­METXBIODB00771)	0.967(DBMET01494;­METXBIODB01957) 0.920(DBMET00186;­DBMET01657;­METXBIODB00774) 0.879(METXBIODB00032 )
Phosphate transporter inhibitor	0.281(DB00492) 0.203(METXBIODB02347) 0.139(METXBIODB02709)	0.613(DBMET01139) 0.464(DBMET02075) 0.160(METXBIODB00897 )
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase inhibitor	0.584(METXBIODB02842) 0.582(DB01424) 0.577(METXBIODB02507;­METXBIODB02821)	0.629(CHEMBL3527192) 0.625(METXBIODB01654) 0.616(DBMET02071 )
5 Hydroxytryptamine 1D antagonist	0.873(METXBIODB01680) 0.867(DB00315) 0.723(DB00953)	0.898(METXBIODB01682) 0.765(DBMET01792) 0.614(DBMET01362 )
Cognition disorders treatment	0.996(DB00185;­METXBIODB00507) 0.949(DB12473) 0.893(DB01591;­DB13345)	0.996(DBMET00430;­DBMET00431;­DBMET00433;­METXBIODB00508) 0.949(CHEMBL3526601) 0.920(CHEMBL3526510 )
Prostacyclin antagonist	0.850(DB00575) 0.626(DB00484) 0.569(DB00697;­METXBIODB02082)	0.736(DBMET00468) 0.596(DB00917) 0.497(CHEMBL3544654;­DBMET00378 )
Plasmin inhibitor	0.720(CHEMBL169901;­DB04840) 0.227(METXBIODB01173) 0.186(DB00188)	0.583(CHEMBL3527068) 0.551(CHEMBL1710849;­DBMET01641) 0.544(CHEMBL3527225;­CHEMBL3527226 )
Gastritis treatment	0.839(DB11739) 0.740(DB00863;­METXBIODB01235) 0.673(DB00585)	0.753(DBMET02354) 0.703(DBMET01735;­METXBIODB01236) 0.652(DBMET01494;­METXBIODB01957 )
GHS receptor antagonist	0.558(DB00191) 0.311(DB12466) 0.253(METXBIODB01087)	0.568(DB01365) 0.354(DBMET02227) 0.138(DB12243 )
Phosphodiesterase 9A inhibitor	0.137(DB00862) 0.059(DB00437) 0.025(DB00203)	0.993(CHEMBL3526601) 0.149(DBMET03640) 0.110(DBMET00414 )
Cyclin A2 inhibitor	0.912(DB09073) 0.397(DB11697) 0.270(METXBIODB03014)	0.875(DBMET02380) 0.865(DBMET02365) 0.802(DBMET02373 )
Hexokinase stimulant	0.068(METXBIODB02345) 0.039(DB01628) 0.035(METXBIODB00811)	0.097(DBMET01536) 0.070(DBMET03403) 0.053(DBMET01537 )
CC chemokine 9 receptor antagonist	0.086(METXBIODB00568) 0.075(DB01628) 0.061(METXBIODB02333)	0.116(DBMET00166) 0.061(DB00891) 0.054(METXBIODB00570 )
Glucose-6-phosphate dehydrogenase inhibitor	0.829(METXBIODB02749) 0.714(DB05087) 0.685(DB02789;­METXBIODB01189)	0.851(METXBIODB01191) 0.849(DBMET02830) 0.833(DBMET01727;­METXBIODB01197 )
Calcium-sensing receptor antagonist	0.449(METXBIODB01550) 0.400(DB09080) 0.375(DB08808)	0.678(DB01365) 0.496(DBMET01507) 0.455(DBMET01505 )
Alpha 1a adrenoreceptor antagonist	0.981(DB13345) 0.915(DB08922;­METXBIODB02106) 0.893(DB00590)	0.895(METXBIODB02107) 0.893(DBMET02603;­DBMET02604) 0.883(DBMET00477;­DBMET02984 )
Vanilloid 4 antagonist	0.075(DB00705;­METXBIODB00682) 0.071(METXBIODB00006) 0.035(DB01012)	0.151(CHEMBL3526366) 0.106(CHEMBL3527291) 0.054(METXBIODB00683 )
Cytidine deaminase inhibitor	0.868(DB15694) 0.767(CHEMBL917;­DB00322) 0.764(DB00441)	0.955(CHEMBL1774;­DBMET02000;­DBMET03590) 0.953(DBMET03588) 0.952(DBMET00859 )
Sirtuin 1 inhibitor	0.211(DB11296) 0.192(DB00129) 0.189(DB00599)	0.620(METXBIODB00240) 0.431(METXBIODB00304) 0.296(METXBIODB01336 )
Antitreponemal	0.314(DB04817) 0.260(METXBIODB02611) 0.251(DB00581)	0.358(CHEMBL3706534) 0.268(METXBIODB00072) 0.256(DBMET01434 )
5 Hydroxytryptamine 2C antagonist	0.992(DB13345) 0.954(DB06077) 0.919(DB00246)	0.795(METXBIODB01366) 0.788(DBMET00106) 0.783(METXBIODB02107 )
Antifungal	0.990(DB00196) 0.982(DB00582) 0.966(DB01294)	0.972(DBMET00071) 0.969(DBMET00072) 0.945(DB11633 )
Urease inhibitor	0.382(DB02546) 0.299(DB00916) 0.248(METXBIODB02879)	0.372(CHEMBL3526839) 0.262(CHEMBL804;­DBMET00977) 0.258(METXBIODB01654 )
CDK2/cyclin A3 inhibitor	0.030(METXBIODB02333) 0.019(CHEMBL727;­DB01035;­DB02377;­METXBIODB02953) 0.018(DB06728;­METXBIODB00266;­METXBIODB01389;­METXBIODB02873;­METXBIODB03012)	0.039(DBMET03666) 0.030(DB00891) 0.027(CHEMBL574 )
Alpha 2 adrenoreceptor agonist	0.934(DB00484) 0.889(DB00697;­METXBIODB02082) 0.759(METXBIODB02856)	0.669(DBMET00465) 0.633(DBMET00464) 0.581(DBMET00468 )
Integrin alpha4beta1 antagonist	0.125(METXBIODB00029) 0.097(DB00731) 0.046(DB01050;­DB09213;­METXBIODB00134;­METXBIODB01970)	0.146(DBMET01121) 0.123(CHEMBL3544779) 0.115(DBMET01401 )
Nav1.1 sodium channel blocker	0.834(DB00532) 0.786(DB00568;­METXBIODB00600) 0.757(CHEMBL16;­DB00252)	0.991(DBMET01096) 0.916(DBMET00056) 0.757(DBMET01170 )
Neurokinin 3 agonist	0.006(DB01255) 0.005(DB11296) 0.003(CHEMBL1046;­DB00130;­DB00513)	0.272(DBMET00506) 0.028(DB03091) 0.024(DBMET02067 )
Phosphodiesterase IX inhibitor	0.153(DB00862) 0.055(DB00437) 0.026(DB00238)	0.991(CHEMBL3526601) 0.167(DBMET03640) 0.138(DBMET00414 )
Alpha 2d adrenoreceptor antagonist	0.383(DB04948) 0.340(METXBIODB02856) 0.290(METXBIODB02632)	0.231(METXBIODB02633) 0.203(CHEMBL4525123;­CHEMBL4525124) 0.189(METXBIODB01388 )
MAO A inhibitor	0.875(METXBIODB02196) 0.769(METXBIODB00464;­METXBIODB02430) 0.729(DB01645;­METXBIODB00465)	0.792(DBMET00251;­METXBIODB00869) 0.713(METXBIODB00272) 0.703(METXBIODB00555 )
Aminopeptidase P inhibitor	0.061(DB06151) 0.054(DB01197) 0.050(DB00182;­DB01576;­METXBIODB01904)	0.327(DBMET01202) 0.099(CHEMBL3706527;­DBMET02776) 0.098(DBMET00503 )
Glucocorticoid antagonist	0.995(METXBIODB01531) 0.954(DB00834) 0.939(DB00687)	0.995(METXBIODB01532) 0.948(METXBIODB02005) 0.932(DB00443 )
ADAM10 endopeptidase inhibitor	0.157(DB02546) 0.128(DB01591) 0.091(METXBIODB00178)	0.195(DBMET02228) 0.097(DBMET03179) 0.090(DBMET01554;­METXBIODB01847 )
Hepatoprotectant	0.906(DB13853) 0.813(CHEMBL3542194) 0.793(DB13751)	0.911(DBMET02057) 0.891(CHEMBL3706475) 0.865(METXBIODB00716 )
Carbonic anhydrase XII inhibitor	0.678(DB00273) 0.549(DB01194) 0.476(METXBIODB02492)	0.623(DBMET00813) 0.567(CHEMBL3544878;­METXBIODB02493) 0.523(DBMET02909;­DBMET02910 )
Calcium channel (voltage-sensitive) blocker	0.902(DB00622) 0.888(CHEMBL1726;­METXBIODB02119) 0.846(METXBIODB02040)	0.759(DBMET01832) 0.754(METXBIODB02122) 0.740(DBMET01833 )
N-Acetylated alpha-linked acidic dipeptidase inhibitor	0.609(CHEMBL109;­DB00313;­METXBIODB01559) 0.532(DB00121) 0.182(DB06151)	0.685(CHEMBL3706509;­DBMET01109) 0.636(DBMET01108) 0.448(DBMET00508 )
Cyclin B3 inhibitor	0.583(DB09073) 0.373(METXBIODB01436) 0.353(METXBIODB02968)	0.751(DBMET02378) 0.749(DBMET02372) 0.702(DBMET01440 )
Carbonic anhydrase IX inhibitor	0.818(DB00273) 0.523(METXBIODB02492) 0.507(CHEMBL118;­DB00482)	0.689(DBMET02909;­DBMET02910) 0.576(DBMET00813) 0.552(CHEMBL3544878;­METXBIODB02493 )
5 Hydroxytryptamine 2 agonist	0.883(DB13345) 0.721(DB04871) 0.705(METXBIODB00475)	0.795(CHEMBL3526304) 0.684(DBMET01732;­DBMET01825;­METXBIODB01849) 0.566(METXBIODB00477 )
MAP3K8 inhibitor	0.067(METXBIODB02395) 0.058(DB06201) 0.057(METXBIODB00230)	0.128(METXBIODB01325) 0.049(DBMET03127) 0.048(CHEMBL3542327;­DBMET02631 )
Interleukin-1 receptor-associated protein kinase 4 inhibitor	0.220(DB11763) 0.196(METXBIODB03014) 0.179(DB11986)	0.260(DBMET00399) 0.216(DBMET03709) 0.213(DBMET03250 )
Apoptosis antagonist	0.795(CHEMBL1783834;­CHEMBL3542194) 0.738(DB00581) 0.736(CHEMBL503;­DB00227;­METXBIODB01008)	0.888(DBMET00986) 0.880(DB00166) 0.863(CHEMBL3542284 )
Protein kinase (CK2) beta inhibitor	0.111(METXBIODB01399) 0.109(METXBIODB00860) 0.107(METXBIODB02912)	0.112(CHEMBL244377) 0.108(CHEMBL1203;­CHEMBL3544872;­CHEMBL457723) 0.091(CHEMBL1222314 )
Nitric oxide donor	0.993(DB00727) 0.989(DB06154) 0.947(DB01020)	0.993(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.956(DBMET02011) 0.889(DB13400 )
CC chemokine 10 receptor antagonist	0.021(CHEMBL498;­DB00672) 0.020(METXBIODB01873) 0.019(DB01124)	0.036(DBMET00920) 0.024(CHEMBL3184360;­DBMET00201) 0.021(CHEMBL3544543;­DBMET00840 )
Secretase beta inhibitor	0.143(DB01656) 0.135(DB01236;­METXBIODB00562) 0.129(METXBIODB02451)	0.178(CHEMBL3186899) 0.174(DBMET01124) 0.172(DBMET01081 )
AMPA 2 receptor antagonist	0.365(CHEMBL445990) 0.226(DB03088) 0.224(METXBIODB01280)	0.352(DBMET00993) 0.278(METXBIODB00919) 0.276(DBMET00494 )
5 Hydroxytryptamine 6 agonist	0.274(DB00669) 0.135(DB00216) 0.124(DB13345)	0.189(DBMET01362) 0.121(DBMET00088) 0.118(DBMET02585 )
Botulinum neurotoxin type A inhibitor	0.465(METXBIODB01504) 0.438(METXBIODB00115;­METXBIODB02046) 0.403(DB02659;­METXBIODB00251)	0.547(DBMET02741;­DBMET03063;­METXBIODB01837;­METXBIODB02047) 0.438(DBMET01559;­DBMET02739) 0.425(METXBIODB00252 )
Protein 30S ribosomal subunit inhibitor	0.946(DB01017) 0.246(DB01190) 0.198(METXBIODB00622)	0.943(DBMET03011) 0.891(DBMET03012) 0.802(DBMET03013 )
Myasthenia Gravis treatment	0.637(CHEMBL160;­DB00091) 0.528(DB16217) 0.423(CHEMBL269732;­DB00864;­METXBIODB00828)	0.624(CHEMBL3544879) 0.529(CHEMBL3544638) 0.528(DBMET03652 )
CC chemokine 3 receptor antagonist	0.297(DB01016) 0.226(CHEMBL54;­DB00502) 0.218(METXBIODB00517)	0.351(DBMET03491) 0.226(CHEMBL4525086;­METXBIODB00519) 0.218(CHEMBL1036;­DBMET00104 )
Alkaline phosphatase inhibitor	0.541(METXBIODB02194) 0.503(METXBIODB02153) 0.502(METXBIODB02603)	0.631(METXBIODB02508) 0.618(METXBIODB03059) 0.600(METXBIODB03033 )
Potassium channel activator	0.453(METXBIODB00565) 0.355(METXBIODB01324) 0.300(METXBIODB02353)	0.819(METXBIODB00566) 0.393(DBMET03610) 0.358(METXBIODB00845 )
Calcium release-activated channel blocker	0.159(DB01097;­METXBIODB01809) 0.078(METXBIODB02345) 0.048(METXBIODB00935;­METXBIODB01430)	0.075(DBMET03127) 0.073(CHEMBL237987) 0.071(DBMET01536 )
Estrogen receptor beta agonist	0.740(METXBIODB00549) 0.562(DB00783;­METXBIODB01814) 0.546(METXBIODB00778;­METXBIODB02190)	0.632(METXBIODB00551) 0.573(METXBIODB00550) 0.562(DBMET00491;­METXBIODB00083 )
Renin inhibitor	0.992(CHEMBL1639) 0.199(DB11296) 0.103(DB00742;­DB11195)	0.989(CHEMBL3507701) 0.988(CHEMBL3507699;­CHEMBL3507700) 0.987(CHEMBL3507703 )
TRPM8 blocker	0.261(DB08921;­METXBIODB00055) 0.198(METXBIODB02370) 0.159(METXBIODB02368)	0.213(METXBIODB00149) 0.211(CHEMBL1222314) 0.181(DBMET03565 )
Antiviral (Bovine viral diarrhea virus)	0.127(DB00296) 0.124(DB00297) 0.115(CHEMBL42;­DB00363;­METXBIODB00638)	0.217(CHEMBL3526603) 0.115(CHEMBL4525085) 0.105(CHEMBL3706476 )
Growth stimulant	0.666(DB14669) 0.656(DB00581) 0.636(DB01234;­METXBIODB00696)	0.805(METXBIODB01088) 0.688(CHEMBL3544715) 0.663(DBMET00826 )
Growth hormone releasing factor agonist	0.342(DB00191) 0.164(DB08868) 0.152(CHEMBL459;­DB00968)	0.268(DB01365) 0.200(DBMET02227) 0.196(CHEMBL3544728 )
Alpha 1 adrenoreceptor antagonist	0.975(DB13345) 0.919(DB08922;­METXBIODB02106) 0.911(DB00590)	0.911(DBMET02603;­DBMET02604) 0.899(METXBIODB02107) 0.897(DBMET00477 )
Toll-Like receptor 9 antagonist	0.435(METXBIODB01205) 0.427(CHEMBL42;­DB00363;­METXBIODB00638) 0.394(DB01183)	0.446(METXBIODB01206) 0.430(METXBIODB01159) 0.427(CHEMBL4525085 )
DNA gyrase subunit B inhibitor	0.339(DB01155) 0.272(DB00537) 0.250(DB01044)	0.183(CHEMBL3544742;­DBMET00631;­METXBIODB01154) 0.182(DBMET02517) 0.173(METXBIODB01321 )
Alpha 2 adrenoreceptor antagonist	0.995(DB13345) 0.975(METXBIODB00475) 0.954(DB00248)	0.900(DBMET02090) 0.894(METXBIODB00477) 0.858(DBMET02603;­DBMET02604 )
Interleukin 2 antagonist	0.877(CHEMBL269732;­DB00864;­METXBIODB00828) 0.834(METXBIODB00831) 0.805(CHEMBL413;­DB00877;­METXBIODB01375)	0.875(CHEMBL3544693;­DBMET00390) 0.872(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.870(CHEMBL3544838 )
HCV polyprotein inhibitor	0.480(DB06799) 0.415(DB11586) 0.273(METXBIODB00664;­METXBIODB02097)	0.538(DBMET02051) 0.417(DBMET02050) 0.385(DBMET02049 )
Butyrylcholinesterase inhibitor	0.974(DB00382) 0.947(METXBIODB02033) 0.938(METXBIODB00591)	0.925(METXBIODB01929) 0.905(DBMET01757) 0.869(DBMET00902 )
Gonadotropin-releasing hormone receptor agonist	0.147(METXBIODB01631) 0.145(METXBIODB02070) 0.128(METXBIODB01173)	0.328(DBMET00513) 0.301(CHEMBL3706522) 0.183(CHEMBL3526347 )
Antineoplastic alkaloid	0.810(METXBIODB02544) 0.807(DB00570) 0.696(DB11641)	0.858(DBMET00398;­DBMET00401) 0.810(DBMET01143;­DBMET02055) 0.685(DBMET02029 )
Vesicle monoamine transporter inhibitor	0.433(DB04844) 0.363(DB01228) 0.359(METXBIODB01946)	0.359(DBMET01815) 0.338(DBMET00458;­DBMET00800;­DBMET01448) 0.328(DBMET01814 )
Thrombolytic	0.581(DB00129) 0.572(DB11296) 0.555(CHEMBL109;­DB00313;­METXBIODB01559)	0.679(DBMET00502) 0.581(DB00123) 0.565(CHEMBL3544550;­DBMET01108 )
Antiviral (Herpes)	0.883(DB14126) 0.857(DB00300) 0.853(CHEMBL184)	0.922(CHEMBL3544772) 0.908(DBMET01173;­METXBIODB01188) 0.885(DB00369 )
Retinoid X gamma receptor antagonist	0.835(DB00755;­DB00982;­METXBIODB00937) 0.798(DB06755) 0.641(METXBIODB03098)	0.835(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.690(DBMET03633) 0.689(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
ATR kinase inhibitor	0.057(METXBIODB00917) 0.055(CHEMBL1258517) 0.051(DB01628)	0.065(DBMET02020) 0.049(DBMET01043) 0.042(METXBIODB00553 )
5 Hydroxytryptamine 1A agonist	0.978(DB08922;­METXBIODB02106) 0.960(DB08815) 0.897(DB00490)	0.977(DBMET00890;­DBMET02989;­METXBIODB01765) 0.973(METXBIODB02107) 0.929(METXBIODB02108 )
Adenosine kinase inhibitor	0.929(DB00640) 0.530(DB00242) 0.278(DB01280)	0.995(DB00171) 0.994(DBMET00769) 0.985(DBMET02967 )
Transcription factor STAT3 inhibitor	0.651(CHEMBL250785;­DB00390) 0.641(METXBIODB00730) 0.530(METXBIODB02142)	0.689(CHEMBL517341) 0.651(DBMET02502;­METXBIODB00731) 0.640(CHEMBL3526207 )
Histone deacetylase 5 inhibitor	0.908(DB02546) 0.873(DB05015) 0.685(CHEMBL483254)	0.873(DBMET01443) 0.554(CHEMBL3527527) 0.545(CHEMBL4525771 )
Cyclin-dependent kinase 6 inhibitor	0.796(DB09073) 0.162(DB00619) 0.160(DB06595)	0.670(DBMET02373) 0.665(DBMET02363;­DBMET02364) 0.607(DBMET02380 )
Antineoplastic (endocrine cancer)	0.889(CHEMBL88;­DB00531;­METXBIODB00960) 0.749(DB12902;­METXBIODB00967) 0.730(DB13751)	0.889(DBMET01683) 0.830(CHEMBL3544546;­DBMET01076) 0.826(CHEMBL3706538 )
Ca(v)3.3 blocker	0.462(METXBIODB01183) 0.442(DB06739;­METXBIODB00580;­METXBIODB03056) 0.438(DB01018)	0.475(DBMET03299) 0.413(DBMET01626;­METXBIODB00582) 0.401(DBMET00905 )
Gastroesophageal reflux disease treatment	0.951(CHEMBL532;­DB00199) 0.933(CHEMBL1741;­DB01211;­METXBIODB00619) 0.913(METXBIODB00769)	0.924(CHEMBL2063468;­DBMET01656) 0.902(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.870(METXBIODB00770 )
Premenstrual syndrome treatment	0.397(DB01395) 0.391(DB04839) 0.378(DB06700)	0.378(METXBIODB00164) 0.371(DBMET02409) 0.368(DBMET02410 )
Antiviral (Hepatitis)	0.981(DB11586) 0.953(CHEMBL1076930) 0.932(DB08934)	0.978(DBMET02051) 0.969(DBMET02050) 0.929(DBMET01381 )
Free fatty acid receptor 1 agonist	0.295(DB01132) 0.246(CHEMBL3526905) 0.241(METXBIODB03150)	0.860(CHEMBL3527206) 0.651(DBMET01365) 0.607(DBMET01300 )
I kappa B kinase 2 inhibitor	0.262(DB11793) 0.159(DB00998) 0.144(DB08828;­METXBIODB01389)	0.200(DBMET03719) 0.184(METXBIODB00553) 0.144(CHEMBL3526631 )
Mineralocorticoid receptor antagonist	0.879(DB01395) 0.875(CHEMBL1393;­DB00421) 0.857(METXBIODB02832)	0.853(CHEMBL3544705;­DBMET02483) 0.836(DBMET00741;­METXBIODB02833) 0.821(DBMET02484;­DBMET02485 )
Antibiotic Aminoglycoside-like	0.149(DB00581) 0.148(DB01190) 0.139(METXBIODB00622)	0.169(DBMET00509) 0.167(CHEMBL3544571;­DBMET00855;­DBMET02006;­DBMET03583) 0.156(DBMET02088 )
Vascular (periferal) disease treatment	0.941(CHEMBL1201772;­DB06209) 0.903(METXBIODB01752) 0.846(CHEMBL1393;­DB00421)	0.972(METXBIODB01308) 0.971(DBMET01163) 0.966(DBMET00483 )
Aggrecanase 1 inhibitor	0.522(METXBIODB01087) 0.197(METXBIODB00204) 0.136(METXBIODB02729)	0.301(METXBIODB00349) 0.283(DBMET00056) 0.261(METXBIODB01088 )
Integrin alphaVbeta3 antagonist	0.711(METXBIODB01514) 0.214(DB00575) 0.135(DB00181)	0.989(METXBIODB01516) 0.739(METXBIODB01515) 0.447(METXBIODB01517 )
Plasminogen activator inhibitor	0.508(CHEMBL169901;­DB04840) 0.428(DB00188) 0.158(METXBIODB01173)	0.306(CHEMBL3527068) 0.258(CHEMBL3527225;­CHEMBL3527226) 0.244(CHEMBL3527010 )
Estrogen receptor beta antagonist	0.994(METXBIODB00549) 0.865(CHEMBL411) 0.845(DB00481;­METXBIODB01232)	0.949(METXBIODB00551) 0.908(METXBIODB00550) 0.833(METXBIODB01234 )
Dopamine D3 agonist	0.697(DB13345) 0.685(METXBIODB00475) 0.625(DB05271)	0.856(DBMET01613) 0.607(METXBIODB00477) 0.589(METXBIODB00476 )
Phosphorylase inhibitor	0.757(METXBIODB02871) 0.640(DB00581) 0.410(CHEMBL917;­DB00322)	0.996(DB01861;­DB03501) 0.991(DBMET03592) 0.988(CHEMBL1774;­DBMET02000;­DBMET03590 )
Transcription factor STAT6 inhibitor	0.477(CHEMBL1117) 0.407(CHEMBL178;­DB00694) 0.318(METXBIODB00860)	0.483(DBMET01158) 0.387(DBMET01160) 0.366(DBMET00485;­DBMET03265 )
Nicotinic neuronal receptor agonist	0.481(CHEMBL3;­DB00184;­METXBIODB02230) 0.388(METXBIODB01383) 0.334(DB01591)	0.623(DBMET00406;­METXBIODB00876) 0.504(CHEMBL6200;­DBMET00520) 0.224(CHEMBL578211;­DBMET00519 )
CDC-like kinase 3 inhibitor	0.837(METXBIODB00382) 0.818(METXBIODB02059) 0.626(METXBIODB01431)	0.734(METXBIODB02060) 0.676(METXBIODB00384) 0.553(METXBIODB00383 )
Potassium channel subfamily K member 3 blocker	0.129(DB00465) 0.097(DB00379;­DB07129;­METXBIODB01843) 0.094(DB04725;­METXBIODB00980)	0.119(METXBIODB01325) 0.117(DBMET00978) 0.101(CHEMBL3527292 )
Neuropeptide agonist	0.686(DB00629) 0.361(METXBIODB00880) 0.204(METXBIODB01173)	0.233(DBMET00502) 0.193(CHEMBL3527294) 0.182(DBMET02065 )
Postmenopausal disorders treatment	0.904(DB01395) 0.887(METXBIODB02832) 0.868(DB00717)	0.868(CHEMBL1162) 0.859(DB09389) 0.857(DBMET00741;­METXBIODB02833 )
Epoxide hydrolase 2 inhibitor	0.141(CHEMBL1076347) 0.043(DB00414) 0.037(DB01067)	0.050(CHEMBL3527500;­CHEMBL3527578) 0.048(DBMET01972;­DBMET03491) 0.047(METXBIODB00240 )
Orexin receptor 2 antagonist	0.721(DB09034) 0.400(CHEMBL1272307) 0.207(CHEMBL455136)	0.232(CHEMBL3527303) 0.207(CHEMBL4525144;­CHEMBL4525145;­CHEMBL4525146;­CHEMBL4525147;­CHEMBL4525148;­CHEMBL4525149;­CHEMBL4525150;­CHEMBL4525151;­CHEMBL4525152;­CHEMBL4525153;­CHEMBL4525154;­CHEMBL4525155;­CHEMBL4525156;­CHEMBL4525157;­CHEMBL4525158;­CHEMBL4525159) 0.159(CHEMBL3526808 )
Cathepsin F inhibitor	0.937(DB06670) 0.080(DB00228;­METXBIODB00116) 0.069(DB05521)	0.722(DBMET01475) 0.635(DBMET01472) 0.491(DBMET01470 )
Retinoid X gamma receptor agonist	0.786(METXBIODB01691) 0.779(DB00755;­DB00982;­METXBIODB00937) 0.713(DB06755)	0.779(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.647(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03633;­DBMET03635;­DBMET03638) 0.636(DBMET00453 )
Antiviral (Dengue virus)	0.455(DB13178) 0.406(DB00640) 0.400(CHEMBL3527223)	0.916(CHEMBL3526603) 0.572(CHEMBL80254) 0.513(CHEMBL3526604 )
Nitric oxide antagonist	0.872(CHEMBL3542194) 0.871(METXBIODB02871) 0.862(DB13751)	0.877(CHEMBL3542275) 0.875(METXBIODB02872) 0.872(CHEMBL3542195;­CHEMBL4525142;­CHEMBL4525143 )
Estrogen agonist	0.976(METXBIODB01947) 0.969(DB00648) 0.889(METXBIODB02004)	0.956(CHEMBL3544578;­DBMET03031) 0.951(CHEMBL1450936;­DBMET01368) 0.929(DBMET03032 )
DNA polymerase beta inhibitor	0.744(METXBIODB00041) 0.727(METXBIODB00856) 0.703(DB00695)	0.970(CHEMBL3527192) 0.947(CHEMBL3544771) 0.798(CHEMBL3706470 )
Obsessive-compulsive disorder treatment	0.668(DB00273) 0.658(METXBIODB00923) 0.510(DB00215;­DB01175)	0.658(DBMET00323;­METXBIODB01276) 0.567(METXBIODB00924) 0.485(DBMET02781;­DBMET03704 )
Alpha adrenoreceptor antagonist	0.994(DB13345) 0.940(DB08922;­METXBIODB02106) 0.939(DB00590)	0.987(DBMET02090) 0.939(DBMET02603;­DBMET02604) 0.938(METXBIODB00476 )
Nicotinic alpha7 receptor agonist	0.374(CHEMBL3;­DB00184;­METXBIODB02230) 0.290(METXBIODB00877) 0.250(DB01591)	0.685(DBMET00406;­METXBIODB00876) 0.173(CHEMBL578211;­CHEMBL6200;­DBMET00519;­DBMET00520) 0.163(METXBIODB00878 )
Glycogen synthase kinase-3 alpha inhibitor	0.458(DB01685;­METXBIODB02526) 0.350(DB00437) 0.325(DB08877)	0.715(DBMET02099) 0.587(DBMET02094) 0.583(DBMET02095 )
Antioxidant	0.954(CHEMBL49563;­DB00163) 0.947(METXBIODB02879) 0.941(DB14002)	0.984(METXBIODB00716) 0.956(DB00166) 0.955(CHEMBL527285;­DBMET02040;­DBMET02324 )
Histone deacetylase class IIa inhibitor	0.925(DB02546) 0.889(DB05015) 0.641(CHEMBL483254)	0.971(CHEMBL3526395) 0.944(CHEMBL3526396) 0.938(CHEMBL3526397 )
Glucagon-like peptide 1 receptor antagonist	0.224(METXBIODB00291) 0.218(METXBIODB01440) 0.176(METXBIODB02378)	0.328(CHEMBL1222314) 0.155(DBMET02012) 0.153(DBMET00725 )
Antibiotic Tetracycline-like	0.840(DB01017) 0.038(CHEMBL174) 0.037(METXBIODB00291)	0.799(DBMET03011) 0.641(DBMET03012;­DBMET03013) 0.036(DBMET03197 )
Guanylate cyclase stimulant	0.900(DB15456) 0.786(DB00727) 0.678(DB06154)	0.900(DBMET03244;­DBMET03245) 0.786(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.349(DBMET02011 )
Bronchodilator	0.947(DB01001) 0.932(DB00871) 0.930(DB09080)	0.934(DBMET01386) 0.932(DBMET03275;­DBMET03276) 0.920(DBMET00386;­METXBIODB01304 )
DNA directed DNA polymerase inhibitor	0.919(DB00709) 0.832(CHEMBL374478) 0.829(METXBIODB00041)	0.992(DBMET00899) 0.972(CHEMBL1201384) 0.965(DBMET00898 )
Retinoic acid gamma receptor agonist	0.911(DB06755) 0.861(DB00755;­DB00982;­METXBIODB00937) 0.692(METXBIODB00323;­METXBIODB01252)	0.861(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.752(DBMET03633) 0.713(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
Antineoplastic antibiotic	0.940(CHEMBL1117) 0.902(DB06263) 0.890(CHEMBL178;­DB00694)	0.909(CHEMBL3544590) 0.879(METXBIODB02105) 0.877(CHEMBL3544591 )
Streptokinase A inhibitor	0.887(DB00698) 0.884(CHEMBL104) 0.785(METXBIODB02721)	0.786(CHEMBL3091852) 0.774(CHEMBL1442231) 0.735(DBMET02707 )
Calcium channel N-type blocker	0.433(DB04841) 0.338(DB00568;­METXBIODB00600) 0.302(DB00737)	0.294(DBMET01198) 0.271(DBMET01197) 0.242(DBMET01124 )
Dual specificity phosphatase inhibitor	0.668(METXBIODB02132) 0.656(METXBIODB01081) 0.652(CHEMBL820)	0.790(DBMET01434) 0.750(METXBIODB02429) 0.707(CHEMBL3526411 )
Cyclin B2 inhibitor	0.647(DB02377) 0.352(DB09073) 0.191(CHEMBL585;­DB00384)	0.698(DBMET00493) 0.614(DBMET02372) 0.535(DBMET02378 )
NMDA 2D receptor antagonist	0.361(METXBIODB02370) 0.335(METXBIODB02368) 0.322(METXBIODB02611)	0.318(METXBIODB02506) 0.272(CHEMBL1208633) 0.264(DBMET02101 )
Phosphodiesterase 4B inhibitor	0.847(DB01656) 0.822(METXBIODB01552) 0.694(METXBIODB01645)	0.934(DBMET00997) 0.844(METXBIODB01555) 0.816(METXBIODB01554 )
Poly(ADP-ribose) polymerase 2 inhibitor	0.678(DB09074) 0.473(DB01261) 0.435(DB12332)	0.716(DBMET03439) 0.594(DBMET03519) 0.559(DBMET03441 )
Retinoid X beta receptor agonist	0.850(METXBIODB01691) 0.785(DB00755;­DB00982;­METXBIODB00937) 0.705(DB06755)	0.785(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.651(DBMET03633) 0.643(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
Acetyl-CoA carboxylase inhibitor	0.659(METXBIODB01344) 0.287(METXBIODB00328) 0.100(CHEMBL1308;­DB01213)	0.636(METXBIODB01345) 0.246(METXBIODB00329) 0.114(DBMET01457 )
Dual specificity phosphatase 3 inhibitor	0.707(METXBIODB02132) 0.690(CHEMBL820) 0.554(METXBIODB02879)	0.796(DBMET01434) 0.747(METXBIODB02429) 0.681(CHEMBL3526411 )
Liver X receptor agonist	0.796(METXBIODB02132) 0.564(DB00532) 0.386(DB06700)	0.386(DBMET00056;­METXBIODB00164) 0.374(DBMET02409) 0.348(DBMET02410 )
Factor Xa inhibitor	0.788(CHEMBL1269025) 0.667(DB12364) 0.522(DB06605)	0.814(CHEMBL3548175) 0.717(CHEMBL3550090) 0.658(CHEMBL3550091 )
Cathepsin S inhibitor	0.825(DB06670) 0.121(METXBIODB00946) 0.120(DB11763)	0.812(DBMET01475) 0.763(DBMET01472) 0.498(DBMET01473 )
Liver X receptor alpha antagonist	0.759(METXBIODB02132) 0.246(METXBIODB01155) 0.156(METXBIODB00289)	0.320(METXBIODB01156) 0.233(DBMET00693) 0.180(METXBIODB00521 )
Antiprotozoal activity enhancer	0.847(DB06697) 0.820(METXBIODB00454) 0.818(DB11638)	0.818(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.806(METXBIODB00455) 0.685(DBMET00827 )
Folate antagonist	0.861(CHEMBL34259) 0.671(DB00563) 0.598(CHEMBL585;­DB00384)	0.840(CHEMBL3544676) 0.786(CHEMBL1231106) 0.723(CHEMBL3544661 )
5 Hydroxytryptamine 6 antagonist	0.403(DB13345) 0.394(METXBIODB01085) 0.356(METXBIODB00475)	0.291(CHEMBL3526332) 0.267(METXBIODB01314) 0.250(CHEMBL1125;­DBMET00265 )
Polo-like kinase-1 inhibitor	0.272(DB00619) 0.258(DB11763) 0.237(DB09073)	0.331(DBMET03528) 0.296(DBMET03530) 0.294(DBMET03719 )
Psychosexual dysfunction treatment	0.710(DB00539) 0.692(METXBIODB02451) 0.654(DB00126)	0.699(DBMET00394) 0.692(DBMET00862) 0.675(CHEMBL50995;­DBMET02716 )
Acetyl-CoA carboxylase 1 inhibitor	0.294(METXBIODB01344) 0.182(METXBIODB00328) 0.083(CHEMBL1308;­DB01213)	0.256(METXBIODB01345) 0.163(METXBIODB00329) 0.048(DBMET02815 )
Glutamate (mGluR2) agonist	0.388(DB00339) 0.268(METXBIODB02380) 0.214(DB06201)	0.593(DBMET02522) 0.277(METXBIODB01626) 0.260(CHEMBL3526838 )
Orexin receptor 1 antagonist	0.690(DB09034) 0.609(CHEMBL1272307) 0.245(CHEMBL455136)	0.313(CHEMBL3527303) 0.245(CHEMBL4525144;­CHEMBL4525145;­CHEMBL4525146;­CHEMBL4525147;­CHEMBL4525148;­CHEMBL4525149;­CHEMBL4525150;­CHEMBL4525151;­CHEMBL4525152;­CHEMBL4525153;­CHEMBL4525154;­CHEMBL4525155;­CHEMBL4525156;­CHEMBL4525157;­CHEMBL4525158;­CHEMBL4525159) 0.238(CHEMBL3526736 )
Glutamate (mGluR group II) agonist	0.394(DB00339) 0.272(METXBIODB02380) 0.219(DB06201)	0.600(DBMET02522) 0.281(METXBIODB01626) 0.274(CHEMBL3526838 )
Aryl hydrocarbon receptor agonist	0.896(METXBIODB00464;­METXBIODB02430) 0.854(METXBIODB02821) 0.849(DB01645;­METXBIODB00465)	0.859(DBMET00251;­METXBIODB00869) 0.843(DBMET01536) 0.842(CHEMBL75589 )
Motilin receptor antagonist	0.670(CHEMBL1741;­DB01211;­METXBIODB00619) 0.668(CHEMBL532;­DB00199) 0.548(METXBIODB00769)	0.844(CHEMBL3706534) 0.568(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.567(CHEMBL2063468;­DBMET01656 )
Granulocyte colony stimulating factor receptor agonist	0.033(METXBIODB00008) 0.029(DB04168;­METXBIODB01220) 0.028(METXBIODB00199)	0.046(CHEMBL2030560) 0.040(DBMET02318) 0.033(CHEMBL3542349 )
Focal adhesion kinase 2 inhibitor	0.717(DB12267) 0.474(CHEMBL535) 0.415(DB12072)	0.437(CHEMBL3542399) 0.413(CHEMBL3542333) 0.389(CHEMBL3542344 )
Contraceptive male	0.810(DB14583) 0.785(DB00294) 0.783(DB00367)	0.975(CHEMBL3706475) 0.845(DBMET01495) 0.801(DBMET01496 )
CC chemokine 8 receptor antagonist	0.030(METXBIODB01452) 0.028(METXBIODB02842) 0.027(METXBIODB01389)	0.132(CHEMBL3527292) 0.032(METXBIODB00183;­METXBIODB01097) 0.030(METXBIODB00936 )
Beta lactamase inhibitor	0.943(DB01606) 0.884(DB00417) 0.774(METXBIODB00835)	0.979(CHEMBL3527192) 0.969(CHEMBL3544771) 0.844(CHEMBL3706470 )
Skin whitener	0.821(METXBIODB02190) 0.798(DB00126) 0.766(DB01094;­METXBIODB02187)	0.829(METXBIODB03144) 0.826(DBMET00253) 0.795(METXBIODB03155 )
Cyclin B1 inhibitor	0.672(DB02377) 0.563(DB09073) 0.206(CHEMBL585;­DB00384)	0.733(DBMET02378) 0.721(DBMET00493) 0.640(DBMET02372 )
DNA repair enzyme inhibitor	0.960(CHEMBL417;­CHEMBL53463;­DB00997) 0.931(CHEMBL178;­DB00694) 0.923(CHEMBL1117)	0.978(CHEMBL3508145) 0.941(DBMET00952) 0.902(DBMET00853 )
Transplant rejection treatment	0.980(DB08868) 0.908(CHEMBL160;­DB00091) 0.906(DB08877)	0.980(DBMET03096) 0.901(CHEMBL3544879) 0.886(CHEMBL2407580;­DBMET00359 )
ICAM1 expression inhibitor	0.761(DB06154) 0.704(CHEMBL1064;­DB00641;­METXBIODB01371) 0.677(DB01234;­METXBIODB00696)	0.702(CHEMBL3542275) 0.691(METXBIODB01656) 0.677(CHEMBL3544664;­CHEMBL3544679;­DB00443 )
MAO B inhibitor	0.869(METXBIODB00300) 0.863(METXBIODB00262) 0.794(METXBIODB00554)	0.807(METXBIODB00555) 0.736(METXBIODB01611) 0.688(METXBIODB00272 )
Antineoplastic (bone cancer)	0.841(DB06670) 0.773(DB01043) 0.672(DB06287)	0.895(CHEMBL525;­DBMET01147) 0.868(CHEMBL3706540;­DBMET01123) 0.865(CHEMBL1593;­DBMET00658 )
Nav1.5 sodium channel blocker	0.536(DB14881) 0.379(METXBIODB01389) 0.295(METXBIODB02842)	0.418(DBMET03206) 0.352(DBMET03208) 0.313(METXBIODB01366 )
Trypsin II inhibitor	0.093(CHEMBL169901;­DB04840) 0.069(METXBIODB01173) 0.062(DB01018)	0.118(CHEMBL65267) 0.097(DBMET03379) 0.089(DBMET01535 )
Endothelin B receptor antagonist	0.831(CHEMBL1111;­DB06403) 0.756(METXBIODB02579) 0.651(DB00559)	0.802(CHEMBL3706460) 0.800(CHEMBL3706461) 0.756(CHEMBL3706459;­DBMET00460 )
Erythropoietin receptor agonist	0.532(DB09059) 0.467(DB11366) 0.436(DB06685)	0.581(DBMET00840) 0.459(DBMET01695) 0.453(DBMET01691 )
Renal disease treatment	0.858(DB15456) 0.776(CHEMBL1393;­DB00421) 0.773(DB00700)	0.858(DBMET03244;­DBMET03245) 0.785(DBMET01540) 0.783(DBMET01655 )
Protein kinase (CK1) epsilon inhibitor	0.138(CHEMBL1140) 0.124(DB00730) 0.095(CHEMBL715;­DB00334;­METXBIODB01125)	0.138(DBMET02629) 0.131(CHEMBL724;­DBMET00354;­DBMET03729;­METXBIODB00201) 0.105(DBMET02020 )
Kallikrein inhibitor	0.569(DB00188) 0.213(DB06201) 0.208(DB01202)	0.344(DBMET03379) 0.275(CHEMBL3526352) 0.273(DBMET03378 )
Protease activated receptor antagonist	0.536(CHEMBL493982;­DB09030) 0.253(METXBIODB01593) 0.230(CHEMBL275391)	0.567(CHEMBL498785;­DBMET01376) 0.527(DBMET01375) 0.516(CHEMBL3542381 )
Fibroblast growth factor 2 antagonist	0.966(DB12147) 0.339(DB06616) 0.254(METXBIODB00866)	0.894(DBMET03649) 0.782(DBMET03650) 0.307(DBMET03737 )
GABA transporter 2 inhibitor	0.272(DB01202) 0.213(DB00568;­METXBIODB00600) 0.187(CHEMBL445990)	0.253(DBMET01115) 0.240(DBMET01193;­METXBIODB00603) 0.205(DBMET01197 )
Growth hormone release promoting	0.284(DB00191) 0.109(DB08868) 0.104(CHEMBL459;­DB00968)	0.364(DB01365) 0.146(CHEMBL3544728) 0.144(DBMET02227 )
Integrin alphaVbeta1 antagonist	0.430(METXBIODB01514) 0.184(DB00575) 0.138(DB00484)	0.451(METXBIODB01515) 0.233(METXBIODB01516) 0.221(METXBIODB01517 )
Diacylglycerol O-acyltransferase 1 inhibitor	0.316(DB11936) 0.192(DB01241;­METXBIODB03090) 0.186(CHEMBL2105653)	0.255(CHEMBL3544586) 0.231(CHEMBL3544587) 0.225(DB09269;­DBMET01431;­METXBIODB03146 )
Antibiotic Glycopeptide-like	0.242(DB11217) 0.240(DB00581) 0.226(CHEMBL3527223)	0.242(DBMET02417) 0.237(METXBIODB02178) 0.235(METXBIODB02255 )
Retinoic acid receptor agonist	0.985(DB06755) 0.971(DB00755;­DB00982;­METXBIODB00937) 0.938(METXBIODB00323;­METXBIODB01252)	0.982(DBMET00454) 0.971(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.948(DBMET03633 )
Tumour necrosis factor antagonist	0.606(DB05676) 0.567(DB01656) 0.541(METXBIODB01531)	0.662(DBMET00997) 0.574(DBMET00056) 0.550(CHEMBL3544501 )
Vasopressin 1B antagonist	0.593(DB01744;­DB11345;­METXBIODB01913) 0.494(DB09059) 0.313(DB00918)	0.304(DBMET00347) 0.222(METXBIODB00690) 0.186(DBMET02067 )
Tubulin agonist	0.114(CHEMBL428647;­DB01229) 0.110(METXBIODB01414) 0.101(CHEMBL92;­DB01248)	0.207(METXBIODB00072) 0.110(CHEMBL122465;­CHEMBL307088;­DBMET01760) 0.107(DBMET01746;­METXBIODB01373 )
MAO inhibitor	0.885(METXBIODB02196) 0.860(METXBIODB00300) 0.832(METXBIODB00262)	0.839(METXBIODB00555) 0.776(METXBIODB01611) 0.775(METXBIODB00272 )
CYP1A2 inhibitor	0.980(METXBIODB01398;­METXBIODB03058) 0.976(METXBIODB02194) 0.975(METXBIODB02507)	0.977(CHEMBL75589) 0.972(CHEMBL74898) 0.967(CHEMBL442289 )
Kinesin antagonist	0.281(DB06824) 0.270(CHEMBL1430) 0.255(DB00820)	0.433(DBMET00513) 0.361(CHEMBL3544531) 0.343(DBMET00486 )
Kinesin-like protein 1 inhibitor	0.281(DB06824) 0.270(CHEMBL1430) 0.255(DB00820)	0.433(DBMET00513) 0.361(CHEMBL3544531) 0.343(DBMET00486 )
5 Hydroxytryptamine 1F antagonist	0.852(DB13345) 0.829(DB00924) 0.827(METXBIODB00369)	0.809(DBMET02090) 0.753(METXBIODB00370) 0.705(METXBIODB00477 )
Neuraminidase inhibitor	0.927(DB00198) 0.298(DB00742;­DB11195) 0.279(METXBIODB02982)	0.944(DBMET02218) 0.390(DBMET01340) 0.370(DBMET02769 )
Transforming growth factor beta 1 antagonist	0.198(DB00730) 0.115(METXBIODB01220) 0.109(METXBIODB00935)	0.168(CHEMBL3526187) 0.147(DBMET03650) 0.114(DBMET01768 )
Cathepsin D inhibitor	0.246(METXBIODB02451) 0.176(CHEMBL1163) 0.159(METXBIODB02531)	0.458(CHEMBL1207) 0.314(CHEMBL3186899) 0.269(CHEMBL3526896 )
Alpha 1L adrenoreceptor antagonist	0.380(DB00261) 0.110(DB00656) 0.108(DB00818;­METXBIODB01201)	0.297(DBMET00772) 0.126(METXBIODB01123) 0.118(DBMET02351;­DBMET02358 )
Somatostatin 3 agonist	0.034(METXBIODB00244) 0.029(DB01221;­DB11823;­METXBIODB00118) 0.028(METXBIODB01146)	0.032(DBMET00189;­METXBIODB00119) 0.022(DBMET01362) 0.020(DBMET01310 )
Potassium channel (Ca-activated) activator	0.609(METXBIODB02793) 0.423(DB06716) 0.410(DB00613)	0.471(DBMET01338) 0.445(DBMET03556) 0.428(METXBIODB00274 )
Vitronectin receptor antagonist	0.816(METXBIODB01514) 0.541(DB00575) 0.311(DB00484)	0.982(METXBIODB01516) 0.838(METXBIODB01515) 0.832(METXBIODB01517 )
Sodium/hydrogen exchanger 2 inhibitor	0.034(DB00533) 0.029(DB01628) 0.025(DB08828)	0.062(CHEMBL3186899) 0.057(CHEMBL3544507) 0.031(DBMET01292 )
Inosine monophosphate dehydrogenase inhibitor	0.845(DB01024;­METXBIODB01063) 0.569(DB00688) 0.328(DB00640)	0.845(DBMET02606) 0.825(DBMET00485;­DBMET03265) 0.815(DB00171 )
Dopamine D4 agonist	0.555(DB00245) 0.500(DB00737) 0.443(DB11742)	0.838(METXBIODB01222) 0.722(DBMET01948) 0.650(DBMET01947 )
Viral attachment inhibitor	0.904(DB11796) 0.853(DB06652) 0.225(DB01320)	0.915(DBMET03183) 0.896(DBMET00080) 0.890(DBMET00081 )
Neuraminidase (influenza) inhibitor	0.774(DB00198) 0.360(DB06799) 0.336(DB00742;­DB11195)	0.818(DBMET02218) 0.376(DBMET01340) 0.355(DBMET03118 )
Cyclin B inhibitor	0.595(DB02377) 0.471(DB09073) 0.223(CHEMBL585;­DB00384)	0.659(METXBIODB01084) 0.638(DBMET00493;­DBMET02378) 0.548(DBMET02372 )
Female sexual dysfunction treatment	0.851(DB00539) 0.755(METXBIODB01526) 0.752(DB00820)	0.869(DBMET00394) 0.810(CHEMBL50995;­DBMET02716) 0.770(METXBIODB01527 )
Prostaglandin D2 antagonist	0.945(METXBIODB00097) 0.938(METXBIODB00744) 0.889(METXBIODB01452)	0.799(DB09269;­DBMET01431;­METXBIODB03146) 0.780(METXBIODB00099) 0.769(METXBIODB00746 )
5 Hydroxytryptamine 1 agonist	0.971(METXBIODB01680) 0.878(DB00315) 0.876(METXBIODB00957)	0.988(METXBIODB01682) 0.942(METXBIODB00959) 0.869(METXBIODB01681 )
Melanin-concentrating hormone receptor 1 antagonist	0.451(DB00637) 0.195(DB06016) 0.182(DB11978)	0.254(DB06457) 0.243(DBMET01618) 0.193(CHEMBL3542260 )
Bone formation stimulant	0.634(METXBIODB00896) 0.633(METXBIODB02719) 0.588(METXBIODB01514)	0.671(METXBIODB00593) 0.656(METXBIODB00897) 0.649(DBMET02435 )
Microtubule stabilization	0.959(CHEMBL92;­DB01248) 0.951(CHEMBL428647;­DB01229) 0.915(DB06772)	0.959(DBMET00633) 0.915(DBMET00998) 0.912(CHEMBL3706530;­DBMET01649 )
ABCA1 expression enhancer	0.890(DB00755;­DB00982;­METXBIODB00937) 0.873(DB06755) 0.845(METXBIODB02963)	0.890(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.868(DBMET03633) 0.856(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
Pim-2 kinase inhibitor	0.122(METXBIODB00639) 0.115(METXBIODB00935) 0.112(METXBIODB02345)	0.231(CHEMBL3526506) 0.197(DBMET01855) 0.159(DBMET01944 )
HIV-1 protease inhibitor	0.820(CHEMBL116) 0.727(DB00224) 0.714(CHEMBL163;­DB00503)	0.897(CHEMBL1235368;­DBMET00983) 0.870(CHEMBL1237008) 0.684(CHEMBL3544831;­DBMET01183 )
Liver X receptor antagonist	0.653(METXBIODB02132) 0.215(METXBIODB01155) 0.170(DB00533)	0.279(METXBIODB01156) 0.249(DBMET00693) 0.228(DBMET00171;­DBMET00172 )
Protease inhibitor	0.899(CHEMBL116) 0.846(CHEMBL1163) 0.597(CHEMBL163;­DB00503)	0.876(CHEMBL3526718) 0.866(CHEMBL3526719) 0.805(CHEMBL3526787 )
Selectin antagonist	0.649(DB00581) 0.618(CHEMBL3527223) 0.561(DB11217)	0.798(DBMET00509) 0.663(METXBIODB03142;­METXBIODB03143) 0.617(DBMET02088 )
Pim-3 kinase inhibitor	0.212(METXBIODB02345) 0.183(DB11640) 0.182(DB06637)	0.274(DBMET01855) 0.240(CHEMBL3526506) 0.224(DBMET01944 )
AMPA receptor agonist	0.696(DB12473) 0.144(CHEMBL445990) 0.131(METXBIODB02963)	0.552(DBMET03765) 0.512(DBMET03764) 0.267(CHEMBL2158192;­DBMET01416 )
Heat shock protein 90 alpha antagonist	0.960(CHEMBL383824) 0.811(CHEMBL467399) 0.524(METXBIODB02376)	0.937(CHEMBL3526785) 0.922(CHEMBL3526786) 0.877(CHEMBL3527105 )
Collagenase inhibitor	0.233(DB02546) 0.178(CHEMBL1314;­DB06823) 0.142(DB05015)	0.222(CHEMBL3527251) 0.206(DBMET01338) 0.182(DBMET03179 )
Catechol O-methyltransferase inhibitor	0.970(DB11632) 0.860(METXBIODB02283) 0.731(METXBIODB02774)	0.953(DBMET03238) 0.938(DBMET03236) 0.936(DBMET03237 )
Erectile dysfunction treatment	0.951(DB00862) 0.948(DB00727) 0.932(DB00820)	0.963(CHEMBL3526838) 0.952(DBMET03640) 0.948(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598 )
Antihemorrhagic	0.919(METXBIODB03141) 0.908(CHEMBL3527416) 0.715(METXBIODB02136)	0.914(CHEMBL3526994) 0.908(CHEMBL3526749;­CHEMBL4525115) 0.902(METXBIODB02880 )
Plasma kallikrein inhibitor	0.271(DB06201) 0.166(DB01202) 0.119(METXBIODB00562)	0.252(CHEMBL3527402) 0.240(CHEMBL3544524) 0.165(CHEMBL3526187 )
Macrophage elastase inhibitor	0.459(CHEMBL109;­DB00313;­METXBIODB01559) 0.267(DB02546) 0.169(DB00230)	0.959(CHEMBL3706502;­DBMET00062;­METXBIODB01562) 0.777(DBMET02168) 0.600(DBMET01108 )
Purinergic P2 antagonist	0.595(DB08816) 0.327(DB11121) 0.306(DB01261)	0.634(DBMET03170) 0.610(DBMET03171) 0.472(DBMET00677 )
Cyclin-dependent kinase 8 inhibitor	0.512(DB05812) 0.393(DB08877) 0.328(DB11793)	0.312(DBMET03262) 0.306(CHEMBL3526899) 0.286(DBMET02824 )
Endothelin receptor antagonist	0.883(CHEMBL1111;­DB06403) 0.818(METXBIODB02579) 0.693(DB00559)	0.863(CHEMBL3706461) 0.818(CHEMBL3706459;­DBMET00460) 0.801(CHEMBL3706460 )
Prostaglandin E2 antagonist	0.748(DB00770) 0.558(DB00929) 0.547(DB00905)	0.803(DB00917) 0.748(DBMET02086) 0.711(DBMET02588 )
Diabetic nephropathy treatment	0.779(DB12713) 0.693(CHEMBL1770248;­DB11827) 0.691(CHEMBL413;­DB00877;­METXBIODB01375)	0.782(DB03947) 0.763(DB09401) 0.730(CHEMBL3527603;­DBMET01906 )
Insulin secretagoues	0.679(METXBIODB00079;­METXBIODB00371) 0.643(METXBIODB00080;­METXBIODB00372) 0.612(METXBIODB02871)	0.741(CHEMBL3527206) 0.684(METXBIODB01150;­METXBIODB01208;­METXBIODB01451) 0.665(METXBIODB00892 )
Antiviral (CMV)	0.921(DB06697) 0.902(METXBIODB00454) 0.900(DB11638)	0.900(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.893(METXBIODB00455) 0.806(DBMET01913;­DBMET03143 )
Caspase 2 inhibitor	0.079(DB00130) 0.074(DB09348) 0.069(DB06218)	0.186(DBMET00169;­DBMET01838) 0.178(DBMET00170) 0.158(DBMET01477 )
GHS receptor agonist	0.366(DB00191) 0.141(DB11296) 0.139(DB06824)	0.252(DBMET02227) 0.183(DBMET02067) 0.167(DBMET03340 )
Integrin beta6 antagonist	0.171(DB00575) 0.119(DB00484) 0.091(DB00697;­METXBIODB02082)	0.160(CHEMBL219497;­DBMET00655;­DBMET02004;­DBMET03581) 0.149(DBMET00468) 0.082(DBMET00465 )
Dual specificity tyrosine-phosphorylation regulated kinase 2 inhibitor	0.867(METXBIODB00382) 0.820(METXBIODB02059) 0.499(METXBIODB01431)	0.683(METXBIODB02060) 0.633(METXBIODB00384) 0.385(METXBIODB00383 )
Baculoviral IAP repeat-containing protein inhibitor	0.426(DB01577;­METXBIODB01797) 0.239(DB00852;­DB01364) 0.145(METXBIODB01521)	0.426(DB09571;­DBMET00634) 0.165(DBMET00735;­METXBIODB01522;­METXBIODB01798) 0.146(METXBIODB00018;­METXBIODB02013 )
Antiobesity	0.966(METXBIODB01543) 0.947(CHEMBL1770248;­DB11827) 0.910(METXBIODB01533)	0.956(CHEMBL3527603;­DBMET01906) 0.948(CHEMBL4525781;­CHEMBL4525782;­DBMET01904;­DBMET01905) 0.934(DBMET01909 )
I kappa B kinase epsilon inhibitor	0.700(DB08877) 0.410(DB08865) 0.341(DB00619)	0.642(DBMET03263) 0.587(DBMET02094) 0.562(DBMET03262 )
Antibiotic beta Lactam-like	0.953(DB01413) 0.846(DB00493) 0.715(DB06211)	0.749(DBMET00646) 0.318(DBMET00758) 0.283(CHEMBL3526531 )
Antiischemic, cerebral	0.865(DB01043) 0.856(METXBIODB01496) 0.848(METXBIODB02793)	0.892(DBMET01740) 0.844(METXBIODB01497) 0.798(CHEMBL1207 )
Histone-lysine N-methyltransferase EZH2 inhibitor	0.928(DB12887) 0.069(DB01429) 0.048(METXBIODB02339)	0.438(DBMET02978) 0.066(DBMET01811) 0.056(DBMET01810 )
I kappa B kinase inhibitor	0.350(DB11793) 0.266(DB08877) 0.207(DB00998)	0.333(DBMET03719) 0.307(DBMET03718) 0.255(CHEMBL3526631 )
Purinergic P2Y4 agonist	0.024(DB15661) 0.005(CHEMBL917;­DB00322) 0.004(DB09144)	0.456(CHEMBL1774;­DBMET02000;­DBMET03590) 0.348(DB01861;­DB03501) 0.327(CHEMBL590981;­DBMET03589 )
Purinergic P2Y14 antagonist	0.411(DB03793;­METXBIODB02476) 0.218(METXBIODB00295) 0.205(METXBIODB01620)	0.411(DBMET01437) 0.256(CHEMBL1203) 0.241(DB02746 )
Baculoviral IAP repeat-containing protein 3 inhibitor	0.147(DB01577;­METXBIODB01797) 0.058(DB00852;­DB01364) 0.046(METXBIODB01521)	0.147(DB09571;­DBMET00634) 0.049(DBMET00735;­METXBIODB01522;­METXBIODB01798) 0.048(CHEMBL3544554 )
Orexin receptor antagonist	0.782(DB09034) 0.781(CHEMBL1272307) 0.369(CHEMBL455136)	0.392(CHEMBL3527303) 0.369(CHEMBL4525144;­CHEMBL4525145;­CHEMBL4525146;­CHEMBL4525147;­CHEMBL4525148;­CHEMBL4525149;­CHEMBL4525150;­CHEMBL4525151;­CHEMBL4525152;­CHEMBL4525153;­CHEMBL4525154;­CHEMBL4525155;­CHEMBL4525156;­CHEMBL4525157;­CHEMBL4525158;­CHEMBL4525159) 0.327(CHEMBL3526736 )
Inosine monophosphate dehydrogenase 2 inhibitor	0.835(DB01024;­METXBIODB01063) 0.384(DB00688) 0.192(DB00640)	0.835(DBMET02606) 0.783(DBMET00485;­DBMET03265) 0.777(DB00171 )
Amyotrophic lateral sclerosis treatment	0.943(CHEMBL269732;­DB00864;­METXBIODB00828) 0.922(DB13345) 0.816(METXBIODB00831)	0.940(CHEMBL3544693;­DBMET00390) 0.928(CHEMBL3544708;­DBMET00670;­DBMET01667;­DBMET01668;­METXBIODB00829;­METXBIODB00830) 0.925(DBMET02090 )
Peristaltic stimulant	0.884(DB00585) 0.833(CHEMBL532;­DB00199) 0.829(DB00863;­METXBIODB01235)	0.904(DBMET00959) 0.848(DBMET02203) 0.847(CHEMBL3706534 )
Vasopressin 2 antagonist	0.604(DB01744;­DB11345;­METXBIODB01913) 0.602(CHEMBL49429) 0.510(DB09059)	0.619(CHEMBL237772) 0.361(CHEMBL3526965) 0.166(CHEMBL392363;­DBMET00840 )
Urolithiasis treatment	0.928(CHEMBL88;­DB00531;­METXBIODB00960) 0.909(DB00700) 0.895(CHEMBL1393;­DB00421)	0.928(DBMET01683) 0.882(DBMET01654) 0.879(DBMET01655 )
Phosphodiesterase III inhibitor	0.977(DB00922) 0.889(METXBIODB00340) 0.695(DB00261)	0.973(DBMET00498) 0.959(DBMET00973) 0.931(DBMET00974 )
Dipeptidyl peptidase I inhibitor	0.160(METXBIODB00350) 0.155(METXBIODB02687) 0.145(METXBIODB02699)	0.157(DBMET02260) 0.142(DBMET02261) 0.131(DBMET01475 )
Endothelin A receptor antagonist	0.886(CHEMBL1111;­DB06403) 0.832(METXBIODB02579) 0.621(DB00559)	0.868(CHEMBL3706461) 0.832(CHEMBL3706459;­DBMET00460) 0.823(CHEMBL3706460 )
Motilin receptor agonist	0.861(CHEMBL532;­DB00199) 0.833(CHEMBL1741;­DB01211;­METXBIODB00619) 0.812(METXBIODB00769)	0.819(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.791(CHEMBL2063468;­DBMET01656) 0.779(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
Dopamine agonist	0.994(DB13345) 0.989(METXBIODB00475) 0.970(METXBIODB00369)	0.989(METXBIODB00476) 0.983(METXBIODB00477) 0.979(DBMET02090 )
Protein-tyrosine phosphatase 1B inhibitor	0.720(CHEMBL820) 0.688(METXBIODB02871) 0.477(DB13751)	0.627(CHEMBL3706503;­DBMET00066;­DBMET00067) 0.615(METXBIODB00356) 0.611(DBMET02110 )
Dopamine transporter inhibitor	0.986(DB00245) 0.951(DB00907;­METXBIODB00058) 0.708(DB01075;­METXBIODB00738)	0.976(DBMET03469;­DBMET03471) 0.961(DBMET02260) 0.908(METXBIODB00059 )
Purinergic P2X antagonist	0.254(DB11121) 0.248(METXBIODB00192) 0.217(METXBIODB00189;­METXBIODB02132)	0.220(DBMET01613) 0.201(DBMET02116) 0.172(DBMET03497 )
Toll-Like receptor 3 antagonist	0.419(DB00289;­METXBIODB00158) 0.408(DB06728) 0.398(DB08865)	0.427(DBMET01200;­METXBIODB02009) 0.408(DBMET02709;­METXBIODB00395) 0.396(DBMET00319;­METXBIODB00122 )
CC chemokine receptor 2B antagonist	0.612(DB00763) 0.324(METXBIODB00189) 0.278(METXBIODB00192)	0.385(DBMET00480) 0.353(DBMET02770) 0.235(DBMET02571 )
Histone deacetylase SIRT2 inhibitor	0.871(CHEMBL104) 0.539(CHEMBL1140) 0.437(METXBIODB01930)	0.539(DBMET02629) 0.244(CHEMBL3542327;­DBMET02631) 0.238(CHEMBL3542314;­DBMET02634 )
Beta amyloid protein antagonist	0.627(METXBIODB02544) 0.441(DB00762;­METXBIODB00933) 0.435(CHEMBL3542194)	0.670(METXBIODB02545) 0.627(DBMET01143) 0.461(CHEMBL3542279;­CHEMBL3542281 )
MAP kinase kinase 10 inhibitor	0.533(DB08881) 0.433(DB00580) 0.268(METXBIODB02395)	0.561(DBMET01344) 0.476(DBMET01342) 0.448(DBMET01347 )
Pyruvate kinase inhibitor	0.625(METXBIODB02548) 0.588(METXBIODB00464;­METXBIODB02430) 0.584(METXBIODB02507)	0.732(DBMET01478) 0.620(DBMET00769) 0.612(CHEMBL3526411 )
AXL receptor tyrosine kinase inhibitor	0.344(DB08865) 0.325(DB12141) 0.242(CHEMBL585;­DB00384)	0.861(CHEMBL244377) 0.854(CHEMBL1231106) 0.831(CHEMBL3544897;­CHEMBL3544898 )
Excitatory amino acid transporter 2 inhibitor	0.452(DB00130) 0.412(DB00129) 0.360(CHEMBL109;­DB00313;­METXBIODB01559)	0.480(DB00142) 0.383(DB00123) 0.315(CHEMBL3706509;­DBMET01109 )
Falcipain inhibitor	0.923(DB06697) 0.918(DB11638) 0.895(METXBIODB00454)	0.998(METXBIODB00716) 0.918(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.909(METXBIODB00455 )
CDK6/cyclin D3 inhibitor	0.867(DB09073) 0.054(DB00592;­DB08864) 0.053(DB12010)	0.805(DBMET02373) 0.761(DBMET02380) 0.675(DBMET02379 )
Anxiolytic	0.992(DB00402;­DB01198;­METXBIODB02096) 0.989(DB06799) 0.980(DB13872)	0.992(DBMET00300) 0.989(DBMET02412) 0.988(DBMET00135;­DBMET00299;­METXBIODB00791 )
Nicotinic receptor beta4 subunit antagonist	0.866(DB01156;­METXBIODB00109;­METXBIODB01854) 0.243(DB06176) 0.221(METXBIODB01741)	0.959(DBMET03469;­DBMET03471) 0.826(DBMET03482;­DBMET03483) 0.813(METXBIODB00113;­METXBIODB01858 )
Protein kinase C beta II inhibitor	0.437(METXBIODB01288) 0.133(DB06595) 0.074(METXBIODB02395)	0.285(METXBIODB01289) 0.224(DBMET01441) 0.107(DBMET01440 )
Transcription factor NF kappa B stimulant	0.799(DB00709) 0.782(DB00879) 0.595(DB13960)	0.790(DBMET00898) 0.783(DBMET00899) 0.735(DBMET02870 )
Glucose-6-phosphate translocase inhibitor	0.548(METXBIODB02170) 0.490(DB11672;­METXBIODB00660) 0.478(METXBIODB02168)	0.490(DBMET01640;­METXBIODB00661) 0.373(METXBIODB02171) 0.349(METXBIODB02167 )
Hypoxia-inducible factor 1 alpha inhibitor	0.995(CHEMBL1504;­CHEMBL1512;­DB06781;­DB14512) 0.994(DB00394;­DB00764) 0.989(DB01234;­METXBIODB00696)	0.995(DBMET00759;­DBMET00837) 0.994(DBMET02361;­DBMET02589) 0.992(DBMET02590;­DBMET02591 )
Somatostatin agonist	0.359(DB09059) 0.268(DB06824) 0.261(DB01074;­METXBIODB00067)	0.545(CHEMBL3706536) 0.319(DBMET03446) 0.259(DBMET00088 )
Antieczematic	0.978(DB00764) 0.971(DB14512) 0.964(DB00394)	0.978(DBMET02361) 0.966(DBMET00759;­DBMET02591) 0.962(DBMET02589 )
Antitussive	0.981(DB00704) 0.970(DB00921;­DB01192) 0.969(DB00497;­METXBIODB01139)	0.994(DB06409;­DBMET00176;­DBMET00660;­METXBIODB02727;­METXBIODB02826) 0.992(METXBIODB03063) 0.990(METXBIODB02827 )
Premature ejaculation treatment	0.648(DB06700) 0.614(DB00285;­METXBIODB00162) 0.502(METXBIODB02677)	0.648(METXBIODB00164) 0.631(DBMET02409) 0.606(DBMET02410 )
Transcription factor STAT inhibitor	0.668(DB00390) 0.667(CHEMBL250785) 0.652(METXBIODB00730)	0.707(CHEMBL3526373) 0.697(CHEMBL517341) 0.668(DBMET02502;­METXBIODB00731 )
Atherosclerosis treatment	0.970(CHEMBL2105653) 0.946(DB06154) 0.944(DB00727)	0.994(METXBIODB00716) 0.959(DBMET01163) 0.956(DBMET01973 )
Nicotinamide phosphoribosyltransferase inhibitor	0.280(DB00250) 0.181(DB00711) 0.166(METXBIODB03012)	0.182(DBMET00014) 0.166(DBMET01043) 0.134(METXBIODB00566 )
Histone deacetylase class III inhibitor	0.826(CHEMBL104) 0.721(METXBIODB01930) 0.542(CHEMBL1140)	0.730(METXBIODB00240) 0.542(DBMET02629) 0.394(DBMET02067 )
Integrin alpha1beta1 antagonist	0.291(METXBIODB02132) 0.104(DB00731;­METXBIODB01155) 0.075(DB04831;­METXBIODB01466)	0.116(DBMET01108) 0.097(DBMET01323;­DBMET01324;­DBMET01831) 0.093(DBMET01477 )
Potassium channel (Inward rectifier) 11 blocker	0.140(METXBIODB00565) 0.067(METXBIODB01439) 0.035(DB00501)	0.364(METXBIODB00566) 0.039(METXBIODB01437) 0.035(DBMET03242;­DBMET03243 )
Phosphodiesterase 3B inhibitor	0.876(DB00922) 0.774(DB00261) 0.688(DB00862)	0.972(DBMET00498) 0.918(DBMET01009;­DBMET01161) 0.886(DBMET00973 )
Falcipain 2 inhibitor	0.923(DB06697) 0.917(DB11638) 0.895(METXBIODB00454)	0.998(METXBIODB00716) 0.917(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.908(METXBIODB00455 )
Factor XI inhibitor	0.120(DB01202) 0.096(DB03088) 0.091(DB00356)	0.933(CHEMBL3527402) 0.263(METXBIODB00936) 0.105(METXBIODB02254 )
Phosphodiesterase 3A inhibitor	0.859(DB00922) 0.721(DB00862) 0.631(METXBIODB00340)	0.870(DBMET00973) 0.835(DBMET00974) 0.726(DBMET03640 )
Poly(ADP-ribose) polymerase 1 inhibitor	0.879(DB09074) 0.528(DB00972;­METXBIODB00107;­METXBIODB01852) 0.504(CHEMBL3527000)	0.924(DBMET00949) 0.921(DBMET03439) 0.719(DBMET02815 )
Activin receptor-like kinase 2 inhibitor	0.523(DB08865) 0.315(DB09073) 0.305(METXBIODB00176)	0.489(DBMET02351;­DBMET02358) 0.468(DBMET03537) 0.314(CHEMBL3040018;­DBMET00025 )
Secretase gamma inhibitor	0.151(METXBIODB00216) 0.143(METXBIODB02298) 0.117(METXBIODB01436)	0.657(CHEMBL3526811) 0.636(CHEMBL3544729) 0.579(DBMET00171;­DBMET00172 )
MAP kinase 3 inhibitor	0.391(DB00352) 0.369(CHEMBL727) 0.286(DB02377)	0.391(DBMET02095) 0.381(DBMET02094) 0.357(DBMET02099 )
Sodium channel (voltage-gated) blocker	0.411(METXBIODB01389) 0.397(CHEMBL118;­DB00482) 0.388(METXBIODB02333)	0.388(DB00891) 0.371(DBMET01730) 0.365(CHEMBL745;­DBMET00165 )
Phosphodiesterase 2A inhibitor	0.451(DB00862) 0.341(DB00853) 0.321(METXBIODB00487)	0.462(DBMET03640) 0.383(DBMET00498) 0.341(DBMET03266;­DBMET03267;­DBMET03268;­DBMET03269 )
Syk tyrosine kinase inhibitor	0.391(DB12010) 0.240(DB12141) 0.236(DB11763)	0.664(DBMET02094) 0.663(DBMET02099) 0.561(DBMET02095 )
p38 MAP kinase inhibitor	0.641(METXBIODB00513) 0.595(DB04951) 0.469(METXBIODB00295)	0.674(DBMET01199) 0.593(DBMET01434) 0.541(METXBIODB01222 )
LIM domain kinase 1 inhibitor	0.689(DB08912) 0.345(CHEMBL741;­DB00555) 0.329(METXBIODB00293)	0.508(DBMET03510) 0.463(DBMET03512) 0.423(CHEMBL3526371 )
Immunomodulator	0.965(CHEMBL88;­DB00531;­METXBIODB00960) 0.962(DB12473) 0.894(DB00631)	0.982(CHEMBL3526838) 0.965(DBMET01683) 0.923(CHEMBL3706475 )
Heat shock protein 90 antagonist	0.994(CHEMBL383824) 0.857(CHEMBL467399) 0.517(METXBIODB02376)	0.990(CHEMBL3526785) 0.982(CHEMBL3526786) 0.976(CHEMBL3527105 )
DNA polymerase III polC-type inhibitor	0.518(METXBIODB02699) 0.478(METXBIODB02733;­METXBIODB02772;­METXBIODB02922) 0.337(DB14921)	0.293(DBMET03497) 0.290(DBMET03496) 0.074(DBMET03498 )
Male reproductive disfunction treatment	0.950(DB00862) 0.947(DB00727) 0.926(DB00820)	0.965(CHEMBL3526838) 0.951(DBMET03640) 0.947(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598 )
Opioid kappa receptor antagonist	0.994(DB00921) 0.979(DB00704) 0.975(METXBIODB01912)	0.975(DBMET00174) 0.957(DBMET00321;­METXBIODB01140) 0.939(DBMET00760 )
Opioid mu receptor antagonist	0.994(DB00704) 0.987(DB00921;­DB01192) 0.972(DB01183)	0.987(DBMET00321;­METXBIODB01140) 0.974(DBMET00760) 0.947(DBMET00427;­DBMET02514 )
Protein kinase (CK2) alpha inhibitor	0.484(DB00962;­METXBIODB01722) 0.466(DB01685;­METXBIODB02526) 0.405(METXBIODB02932)	0.594(DBMET00399) 0.570(DBMET03526) 0.506(METXBIODB01723 )
Polo-like kinase-2 inhibitor	0.173(DB06595) 0.157(DB00889;­METXBIODB00874) 0.143(METXBIODB01425)	0.337(DBMET02759) 0.189(CHEMBL3542324) 0.153(DBMET03436 )
Nav1.7 sodium channel blocker	0.282(METXBIODB01389) 0.264(METXBIODB02333) 0.259(METXBIODB00568)	0.264(DB00891) 0.228(METXBIODB00569) 0.223(METXBIODB01366 )
5 Hydroxytryptamine 7 antagonist	0.932(METXBIODB00475) 0.922(DB13345) 0.845(METXBIODB00369)	0.928(METXBIODB00477) 0.926(METXBIODB00476) 0.832(DBMET02090 )
Vanilloid antagonist	0.446(DB00705;­METXBIODB00682) 0.423(DB12015) 0.324(DB09048)	0.382(DBMET02571) 0.366(DBMET01380) 0.365(DBMET00360;­METXBIODB00684 )
Caspase 6 inhibitor	0.047(DB09149) 0.036(DB00121) 0.033(DB03766)	0.055(CHEMBL3526370;­DBMET00169;­DBMET01838) 0.054(DBMET01427;­DBMET01477) 0.053(DBMET01476 )
Phosphodiesterase 5A inhibitor	0.950(DB00862) 0.942(DB00820) 0.936(DB00203)	0.949(DBMET03640) 0.942(DBMET03416) 0.941(DBMET00421;­METXBIODB01331 )
Phosphodiesterase V inhibitor	0.953(DB00820) 0.948(DB00862) 0.934(DB00203)	0.953(DBMET03416) 0.947(DBMET03640) 0.940(DBMET00421;­METXBIODB01331 )
Phosphodiesterase II inhibitor	0.466(DB00862) 0.350(DB00853) 0.331(METXBIODB00487)	0.475(DBMET03640) 0.392(DBMET00498) 0.350(DBMET03266;­DBMET03267;­DBMET03268;­DBMET03269 )
Retinoic acid receptor antagonist	0.890(DB06755) 0.887(DB00755;­DB00982;­METXBIODB00937) 0.812(METXBIODB01691)	0.887(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.867(DBMET03633) 0.838(DBMET00455;­DBMET02550;­DBMET02552;­DBMET03635;­DBMET03638 )
Antiamyloidogenic	0.884(METXBIODB02544) 0.858(DB00762;­METXBIODB00933) 0.782(DB09298)	0.913(METXBIODB02545) 0.907(DBMET01681;­METXBIODB00934) 0.884(DBMET01143 )
Antischistosomal	0.835(DB11638) 0.824(DB06697) 0.810(METXBIODB00454)	0.835(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.831(METXBIODB00455) 0.795(DBMET00827 )
Purinergic P2X agonist	0.253(DB00242) 0.220(DB00631) 0.137(DB00640)	0.590(DBMET00677) 0.528(DB00171) 0.429(DBMET00769 )
Caspase 9 inhibitor	0.176(DB05521) 0.163(DB06154) 0.157(DB03766)	0.652(DBMET00986) 0.275(DBMET01476) 0.232(DBMET01477 )
5 Hydroxytryptamine 1B agonist	0.943(DB13345) 0.917(METXBIODB00475) 0.908(METXBIODB00369)	0.955(DBMET02090) 0.942(METXBIODB00476) 0.936(METXBIODB00370 )
KiSS-1 receptor antagonist	0.037(DB06824) 0.035(DB12783) 0.026(METXBIODB01173)	0.063(DBMET02761) 0.044(DBMET02067) 0.030(DBMET00502 )
Fibroblast growth factor 3 antagonist	0.959(DB12147) 0.293(DB00619) 0.243(DB14840)	0.889(DBMET03649) 0.744(DBMET03650) 0.293(CHEMBL941 )
Potassium channel (Inward rectifier) 1 blocker	0.060(DB00533) 0.058(DB09348) 0.056(DB00688)	0.059(DBMET02690) 0.058(DBMET00767;­METXBIODB01064) 0.056(DBMET02607 )
Antiviral (Influenza A)	0.921(DB13997) 0.893(DB00198) 0.806(DB06799)	0.934(DB15675) 0.910(DBMET02218) 0.674(DBMET03320 )
ATPase (Vacuolar H+) inhibitor	0.232(DB00581) 0.203(METXBIODB00831) 0.199(METXBIODB01833)	0.281(METXBIODB01144) 0.219(DBMET03415) 0.203(CHEMBL3544602;­CHEMBL3544709;­CHEMBL3544837;­DBMET01753;­METXBIODB00832;­METXBIODB01381 )
Adenine nucleotide translocase inhibitor	0.796(CHEMBL1430) 0.369(METXBIODB01301) 0.203(DB01250)	0.867(CHEMBL3544554) 0.823(CHEMBL3544532) 0.759(CHEMBL3544531 )
Histone deacetylase 1 inhibitor	0.987(DB02546) 0.938(DB05015) 0.874(CHEMBL483254)	0.994(CHEMBL3526395) 0.964(CHEMBL3526396) 0.941(CHEMBL3526943 )
MAP kinase kinase 2 inhibitor	0.891(DB11689) 0.834(DB08911) 0.641(CHEMBL535)	0.914(DBMET03643) 0.905(DBMET03641) 0.840(DBMET03102 )
Integrin alpha5beta1 antagonist	0.525(METXBIODB01514) 0.466(CHEMBL1430) 0.195(DB06151)	0.554(METXBIODB01515) 0.301(DBMET00503) 0.285(METXBIODB01517 )
Dopamine D5 antagonist	0.983(METXBIODB00475) 0.904(DB13345) 0.855(DB00714)	0.974(METXBIODB00477) 0.973(METXBIODB00476) 0.941(CHEMBL3527031;­DBMET00096 )
Opioid delta receptor antagonist	0.985(DB00704) 0.971(DB01192) 0.953(DB01183)	0.971(DBMET00321;­METXBIODB01140) 0.934(DBMET00760) 0.915(DBMET00424 )
Antibiotic Penicillin-like	0.369(CHEMBL174) 0.311(DB01060) 0.310(CHEMBL29;­DB01053)	0.667(DBMET00758) 0.374(DBMET02999) 0.296(DBMET02997 )
Opioid antagonist	0.994(DB00921) 0.992(DB00704) 0.984(DB01192)	0.984(DBMET00321;­METXBIODB01140) 0.981(DBMET00174) 0.973(DBMET00760 )
Antiprotozoal (Histomonas)	0.824(DB00614) 0.630(METXBIODB02480) 0.561(DB12265)	0.601(DBMET01012) 0.527(DBMET03402;­DBMET03403) 0.406(METXBIODB02481 )
Myocardial infarction treatment	0.960(CHEMBL1201772;­DB06209) 0.958(DB00727) 0.882(METXBIODB01752)	0.966(DBMET00483) 0.961(DBMET01163) 0.959(METXBIODB01308 )
Antihypertriglyceridemic	0.846(CHEMBL672;­DB01039) 0.829(DB11936) 0.824(METXBIODB00169)	0.850(CHEMBL3544523) 0.845(DBMET01300) 0.827(DBMET01365 )
Opioid mu receptor agonist	0.994(DB00921) 0.989(METXBIODB01912) 0.942(METXBIODB03062)	0.989(DBMET00174) 0.942(DBMET00176) 0.930(DBMET00321;­METXBIODB01140 )
H+/K+-transporting ATPase inhibitor	0.962(CHEMBL1503;­DB00338;­DB00736;­METXBIODB00771) 0.938(DB00213;­METXBIODB00543) 0.927(METXBIODB01973)	0.926(DBMET00186;­DBMET01657;­METXBIODB00774) 0.865(METXBIODB00032) 0.862(DBMET01822 )
Cyclin-dependent kinase 9 inhibitor	0.408(DB09073) 0.342(METXBIODB02333) 0.283(DB08912)	0.382(DBMET02380) 0.344(DBMET00028) 0.342(DB00891 )
DNA polymerase III inhibitor	0.442(DB14921) 0.401(METXBIODB02699) 0.386(METXBIODB02733;­METXBIODB02772;­METXBIODB02922)	0.379(DBMET03496;­DBMET03497) 0.265(METXBIODB01456) 0.239(DBMET03498 )
Xanthine oxidase substrate	0.894(CHEMBL727) 0.857(DB01033) 0.793(DB00352)	0.976(CHEMBL1426) 0.909(CHEMBL1230639) 0.875(DBMET00611 )
NOS3 expression enhancer	0.992(METXBIODB00715) 0.794(METXBIODB02717) 0.770(DB01234;­METXBIODB00696)	0.930(METXBIODB00716) 0.784(DBMET01434) 0.770(DB00443 )
Antiprotozoal (Leishmania)	0.952(DB06697) 0.951(DB11638) 0.942(METXBIODB00454)	0.951(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.947(METXBIODB00455) 0.913(CHEMBL3706540;­DBMET01123 )
Sodium/hydrogen exchanger 5 inhibitor	0.322(DB11362) 0.239(METXBIODB00562) 0.212(METXBIODB01173)	0.346(DBMET01403) 0.294(CHEMBL3544893;­DBMET02468) 0.280(DBMET02144 )
Excitatory amino acid transporter 1 inhibitor	0.365(DB00130) 0.337(DB00129) 0.112(CHEMBL109;­DB00313;­METXBIODB01559)	0.414(DB00142) 0.295(DB00123) 0.224(DBMET00486 )
CDK4/cyclin D3 inhibitor	0.544(DB09073) 0.050(METXBIODB02408) 0.049(METXBIODB01812)	0.536(DBMET02373) 0.481(DBMET02380) 0.280(DBMET02376 )
Histone deacetylase class IIb inhibitor	0.975(DB02546) 0.821(DB05015) 0.539(CHEMBL483254)	0.994(CHEMBL3526395) 0.948(CHEMBL3526396) 0.924(CHEMBL3526397 )
Histone deacetylase class II inhibitor	0.970(DB02546) 0.916(DB05015) 0.690(CHEMBL483254)	0.986(CHEMBL3526395) 0.916(DBMET01443) 0.864(CHEMBL3526396 )
Analgesic, opioid	0.993(DB00921) 0.987(DB00704;­METXBIODB01912) 0.983(DB01192)	0.987(DBMET00174) 0.986(DBMET00424) 0.983(DBMET00321;­METXBIODB01140 )
Histone deacetylase 6 inhibitor	0.976(DB02546) 0.821(DB05015) 0.536(CHEMBL483254)	0.994(CHEMBL3526395) 0.950(CHEMBL3526396) 0.925(CHEMBL3526397 )
Prokinetic	0.908(CHEMBL532;­DB00199) 0.900(CHEMBL1741;­DB01211;­METXBIODB00619) 0.888(DB00778;­METXBIODB01286)	0.896(CHEMBL3544830;­DBMET00356;­METXBIODB00620) 0.890(CHEMBL2063468;­DBMET01656) 0.889(CHEMBL3706534 )
Trypsin I inhibitor	0.750(CHEMBL169901;­DB04840) 0.224(DB13729) 0.120(METXBIODB01173)	0.620(CHEMBL3527068) 0.602(CHEMBL1710849;­DBMET01641) 0.576(CHEMBL3527224 )
Phosphodiesterase 4D inhibitor	0.860(DB01656) 0.792(METXBIODB01645) 0.765(DB00862)	0.925(DBMET00997) 0.853(CHEMBL1207) 0.781(DBMET03640 )
Complement C3a chemotactic receptor antagonist	0.234(METXBIODB01173) 0.178(DB00129) 0.156(METXBIODB00562)	0.567(DBMET02708) 0.470(DBMET00502) 0.461(DBMET02707 )
mTOR inhibitor	0.771(CHEMBL1258517) 0.597(METXBIODB00817) 0.529(CHEMBL413;­DB00877;­METXBIODB01375)	0.706(CHEMBL3526762) 0.584(METXBIODB00819) 0.529(DBMET00628;­METXBIODB00818 )
Fibrosis treatment	0.727(METXBIODB01514) 0.720(DB15456) 0.638(CHEMBL1308;­DB01213)	0.733(METXBIODB01515) 0.720(DBMET03244;­DBMET03245) 0.656(METXBIODB01517 )
Poly(ADP-ribose) polymerase inhibitor	0.903(DB09074) 0.557(DB00972;­METXBIODB00107;­METXBIODB01852) 0.556(CHEMBL3527000)	0.939(DBMET03439) 0.932(DBMET00949) 0.755(DBMET02815 )
Neurokinin 3 antagonist	0.341(DB09048) 0.266(CHEMBL515387) 0.131(DB01058)	0.333(DBMET01379) 0.313(CHEMBL3526734) 0.283(DBMET01380 )
Dipeptidyl peptidase VIII inhibitor	0.733(DB01261) 0.667(DB04876) 0.616(CHEMBL385517;­DB06335)	0.608(CHEMBL3350936;­DBMET00459) 0.326(CHEMBL3542418) 0.320(DBMET02432 )
Andropause treatment	0.463(DB00539) 0.189(METXBIODB00273) 0.173(METXBIODB02451)	0.405(DBMET00394) 0.269(DBMET01828;­METXBIODB01998) 0.177(DBMET00249 )
Protein kinase (CK2) inhibitor	0.343(DB00962;­METXBIODB01722) 0.339(DB01685;­METXBIODB02526) 0.307(METXBIODB02932)	0.468(DBMET03526) 0.451(DBMET00399) 0.382(METXBIODB01723 )
Dipeptidyl peptidase IX inhibitor	0.662(DB04876) 0.661(CHEMBL385517;­DB06335) 0.605(DB01261)	0.651(CHEMBL3350936;­DBMET00459) 0.287(CHEMBL3542418) 0.184(DBMET03322 )
Purinergic P2Y agonist	0.064(DB15661) 0.050(DB00640) 0.043(CHEMBL1076930)	0.749(DB00171) 0.712(CHEMBL1774;­DBMET02000;­DBMET03590) 0.611(DB01861;­DB03501 )
Baculoviral IAP repeat-containing protein 2 inhibitor	0.164(DB01577;­METXBIODB01797) 0.039(DB00852;­DB01364) 0.031(METXBIODB01521)	0.164(DB09571;­DBMET00634) 0.030(DBMET00735;­METXBIODB01522;­METXBIODB01798) 0.026(CHEMBL3544890;­DBMET02973 )
Prostatic (benign) hyperplasia treatment	0.975(CHEMBL710;­DB01216) 0.894(METXBIODB00826) 0.826(CHEMBL1200374)	0.936(CHEMBL4525755) 0.932(CHEMBL3542374) 0.865(DBMET00369 )
Interleukin 6 antagonist	0.874(CHEMBL532;­DB00199) 0.873(CHEMBL1741;­DB01211;­METXBIODB00619) 0.868(DB00778;­METXBIODB01286)	0.861(CHEMBL2063468;­DBMET01656) 0.859(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.855(METXBIODB01287 )
Sodium channel blocker	0.453(METXBIODB01389) 0.435(METXBIODB02333) 0.418(DB01015;­METXBIODB01391)	0.435(DB00891) 0.367(DBMET01730) 0.362(DBMET03575 )
CC chemokine receptor antagonist	0.934(DB06652) 0.570(DB00836) 0.481(METXBIODB00192)	0.975(DBMET00080) 0.966(DBMET00083) 0.958(DBMET00081 )
5 Hydroxytryptamine 1F agonist	0.382(METXBIODB00178) 0.230(DB00669) 0.142(METXBIODB02345)	0.477(DBMET03516) 0.200(DBMET03527) 0.112(METXBIODB00180 )
MAP kinase kinase 1 inhibitor	0.741(DB11689) 0.447(DB08911) 0.305(DB06616)	0.708(DBMET03102) 0.548(DBMET03641) 0.469(DBMET03643 )
Purinergic P2 agonist	0.073(DB15661) 0.060(DB00640) 0.053(DB00631)	0.757(DB00171) 0.714(CHEMBL1774;­DBMET02000;­DBMET03590) 0.608(DB01861;­DB03501 )
Purinergic receptor agonist	0.073(DB15661) 0.060(DB00640) 0.053(DB00631)	0.757(DB00171) 0.714(CHEMBL1774;­DBMET02000;­DBMET03590) 0.608(DB01861;­DB03501 )
Contraceptive	0.992(METXBIODB01137) 0.974(DB00294) 0.969(DB00367)	0.978(METXBIODB01138) 0.969(DB09389) 0.964(DBMET00723;­DBMET00724;­DBMET01642;­DBMET01643;­METXBIODB00695 )
Potassium channel (Ca-activated) blocker	0.902(CHEMBL104) 0.403(METXBIODB00008) 0.375(METXBIODB02426)	0.437(DBMET00675) 0.334(DB06457) 0.328(CHEMBL2030560 )
CXC chemokine 1 receptor antagonist	0.357(CHEMBL104) 0.257(METXBIODB00075) 0.230(METXBIODB00793)	0.260(METXBIODB00076) 0.256(CHEMBL1379) 0.235(METXBIODB00794 )
Acute neurologic disorders treatment	0.908(METXBIODB02793) 0.843(METXBIODB01471) 0.834(CHEMBL49563;­DB00163)	0.855(METXBIODB02794) 0.845(CHEMBL527285;­DBMET02040;­DBMET02324) 0.835(DBMET02039;­DBMET02323 )
Cardioprotectant	0.998(DB01236) 0.990(DB00727) 0.976(DB09282)	0.990(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.986(DB13400) 0.938(METXBIODB01068 )
Retinopathy treatment	0.843(DB00700) 0.747(DB00727) 0.652(DB01194)	0.765(DBMET01655) 0.761(DBMET01654) 0.747(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598 )
Egl nine homolog 2 inhibitor	0.098(DB11901) 0.083(DB11682) 0.080(CHEMBL467399)	0.107(DBMET03639) 0.101(DBMET01923) 0.087(CHEMBL375462 )
CYP2D6 inhibitor	0.894(CHEMBL163;­DB00503) 0.840(DB00468;­DB00908;­METXBIODB01215;­METXBIODB01218) 0.827(DB00857)	0.877(DBMET01731;­METXBIODB01217) 0.875(CHEMBL3544832) 0.840(DBMET00382;­DBMET00383;­METXBIODB01216;­METXBIODB01219 )
Protein kinase C beta I inhibitor	0.722(METXBIODB01288) 0.133(DB06595) 0.046(METXBIODB01320)	0.614(METXBIODB01289) 0.276(DBMET01440) 0.092(DBMET01441 )
Dopamine D1 agonist	0.483(DB00714) 0.400(DB13345) 0.288(METXBIODB00369)	0.423(DBMET03133) 0.333(METXBIODB02098) 0.327(METXBIODB00665 )
Leucine-rich repeat kinase 2 inhibitor	0.480(DB12267) 0.365(DB08877) 0.188(DB11986)	0.288(DBMET02094) 0.270(DBMET03650) 0.224(DBMET03710 )
Free fatty acid receptor 2 antagonist	0.014(METXBIODB01939) 0.012(METXBIODB01859) 0.007(METXBIODB01882;­METXBIODB02132)	0.011(METXBIODB01941) 0.010(METXBIODB01940) 0.008(DBMET01477 )
Protein kinase C alpha inhibitor	0.970(DB06595) 0.425(METXBIODB01288) 0.297(DB00437)	0.970(DBMET01440) 0.969(DBMET01441) 0.745(CHEMBL3544902;­DBMET02826 )
Retinoic acid receptor gamma antagonist	0.934(DB06755) 0.914(DB00755;­DB00982;­METXBIODB00937) 0.873(METXBIODB01691)	0.914(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.867(DBMET03633) 0.839(DBMET00453 )
Purinergic P2X7 antagonist	0.206(METXBIODB02132) 0.203(DB11121) 0.202(METXBIODB00192)	0.183(DBMET01613) 0.128(DBMET02432) 0.116(METXBIODB00566 )
MAP kinase kinase kinase inhibitor	0.353(DB08865) 0.328(DB14840) 0.269(DB06201)	0.376(DBMET03101) 0.340(METXBIODB01325) 0.335(CHEMBL3526371 )
Estrogen-related receptor beta antagonist	0.506(CHEMBL83;­DB00675;­METXBIODB01400) 0.473(METXBIODB00268) 0.453(METXBIODB01404)	0.913(CHEMBL50995;­DBMET02716) 0.539(DBMET02715) 0.473(CHEMBL2137046;­DBMET00030;­METXBIODB01402 )
CXC chemokine receptor agonist	0.507(DB00730) 0.054(DB11932) 0.049(METXBIODB00628)	0.211(DBMET01768) 0.092(CHEMBL3706522) 0.071(CHEMBL3706476 )
Oxytocin antagonist	0.682(DB01744;­DB11345;­METXBIODB01913) 0.633(DB09059) 0.299(DB00918)	0.288(DBMET00347) 0.276(CHEMBL237772) 0.244(DBMET00840 )
Integrin antagonist	0.870(METXBIODB01514) 0.790(METXBIODB00029) 0.531(DB00731)	0.968(METXBIODB01516) 0.888(METXBIODB01515) 0.684(METXBIODB00030 )
Retinoic acid alpha receptor antagonist	0.908(DB00755;­DB00982;­METXBIODB00937) 0.902(DB06755) 0.835(METXBIODB01691)	0.908(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.889(DBMET03633) 0.847(DBMET00453 )
Protein kinase C eta inhibitor	0.960(DB06595) 0.342(METXBIODB01288) 0.203(DB00495;­METXBIODB02133)	0.965(DBMET01440) 0.907(DBMET01441) 0.302(METXBIODB01289 )
Acute respiratory distress syndrome (ARDS) treatment	0.805(DB06756) 0.794(CHEMBL532;­DB00199) 0.786(METXBIODB01297)	0.995(METXBIODB02429) 0.773(CHEMBL2063468;­DBMET01656) 0.758(CHEMBL2022715;­DBMET00357;­METXBIODB00621 )
CYP24 inhibitor	0.642(CHEMBL820) 0.566(CHEMBL846;­DB00136) 0.534(DB00153;­METXBIODB01575;­METXBIODB02762)	0.574(CHEMBL3544529;­DBMET00575) 0.540(CHEMBL3351075;­CHEMBL3542403) 0.536(DBMET02435 )
Neurokinin 2 antagonist	0.254(CHEMBL515387) 0.192(DB00216) 0.179(DB01058)	0.405(CHEMBL3526734) 0.357(CHEMBL3527515) 0.264(CHEMBL3526894 )
Acetyl-CoA carboxylase 2 inhibitor	0.637(METXBIODB01344) 0.292(METXBIODB00328) 0.067(CHEMBL1308;­DB01213)	0.620(METXBIODB01345) 0.257(METXBIODB00329) 0.086(DBMET01457 )
DNA polymerase III subunit alpha inhibitor	0.046(METXBIODB01455) 0.023(METXBIODB00487) 0.021(METXBIODB02420)	0.202(METXBIODB01456) 0.034(DBMET00498) 0.028(METXBIODB01458 )
MAP kinase kinase inhibitor	0.909(DB11689) 0.662(DB08911) 0.485(DB08881)	0.861(DBMET03102) 0.748(DBMET03641) 0.720(DBMET03643 )
Adenosine A3 receptor agonist	0.573(DB00242) 0.516(DB00631) 0.421(DB00640)	0.305(DBMET00419) 0.276(CHEMBL3526900) 0.274(DBMET00677 )
Bipolar disorder treatment	0.870(DB00273) 0.850(METXBIODB00255) 0.808(CHEMBL715;­DB00334;­METXBIODB01125)	0.972(DBMET01310) 0.970(DBMET00189;­METXBIODB00119) 0.945(DBMET01309 )
Stroke treatment	0.962(METXBIODB02424) 0.952(DB13853) 0.922(METXBIODB01752)	0.993(METXBIODB01298) 0.963(DBMET02057) 0.942(DBMET00483 )
Antineoplastic (sarcoma)	0.984(DB01181;­METXBIODB00963) 0.980(METXBIODB03049) 0.975(DB12902;­METXBIODB00967)	0.992(DBMET01127) 0.980(DBMET00024;­METXBIODB00966) 0.977(CHEMBL87658;­DBMET00020;­DBMET00021;­METXBIODB00961;­METXBIODB00964 )
Adrenaline uptake inhibitor	0.973(METXBIODB01237) 0.906(DB06700) 0.892(CHEMBL259209;­DB04896;­DB08918)	0.984(DBMET03469;­DBMET03471) 0.977(METXBIODB01238) 0.959(DBMET02412 )
Antiprotozoal (Trypanosoma)	0.975(DB11637) 0.946(DB05154) 0.816(DB01131)	0.912(CHEMBL3526480;­CHEMBL4525783) 0.815(DBMET01683) 0.773(CHEMBL3706540;­DBMET01123 )
TRKA antagonist	0.452(DB08865) 0.437(DB06595) 0.267(CHEMBL535)	0.404(DBMET03537) 0.341(DBMET01441) 0.321(CHEMBL3542333 )
Trypsin inhibitor	0.787(CHEMBL169901;­DB04840) 0.419(METXBIODB02662) 0.282(METXBIODB00034)	0.748(METXBIODB00590) 0.643(CHEMBL3527068) 0.613(CHEMBL1710849;­DBMET01641 )
Bcr-Abl kinase inhibitor	0.807(DB00619) 0.579(DB01254) 0.227(DB00398)	0.807(CHEMBL941) 0.682(DBMET00028) 0.647(CHEMBL3040018;­DBMET00025 )
Chemokine receptor agonist	0.558(DB00730) 0.548(CHEMBL104) 0.111(DB06652)	0.275(DBMET01768) 0.184(DBMET00080) 0.156(CHEMBL3706522 )
Antiviral (Hepatitis D)	0.720(METXBIODB01187) 0.582(DB00300) 0.532(DB09299)	0.495(DBMET03569) 0.471(DBMET01177) 0.461(DBMET01425 )
Insulin like growth factor 1 antagonist	0.996(DB12267) 0.259(DB05294) 0.240(DB00619;­DB11986)	0.263(DBMET02094) 0.240(CHEMBL941) 0.228(DBMET00935 )
Bcl2 antagonist	0.900(DB11581) 0.312(CHEMBL88;­DB00531;­METXBIODB00960) 0.302(METXBIODB02351)	0.358(DBMET02996) 0.312(DBMET01683) 0.302(METXBIODB01918 )
Cyclin D3 inhibitor	0.869(DB09073) 0.193(DB12010) 0.152(DB00592)	0.849(DBMET02380) 0.848(DBMET02373) 0.841(DBMET02378 )
Vasopressin 1A antagonist	0.702(DB01744;­DB11345;­METXBIODB01913) 0.594(CHEMBL49429) 0.588(DB09059)	0.336(CHEMBL237772) 0.270(CHEMBL3526965) 0.262(CHEMBL3246317;­DBMET00112 )
Toll-Like receptor 7 antagonist	0.414(CHEMBL1455) 0.239(DB00592) 0.215(METXBIODB01229)	0.241(CHEMBL3544874) 0.229(DBMET03527) 0.215(DBMET01732;­DBMET01825;­METXBIODB01849 )
Rho-associated kinase I inhibitor	0.308(DB08877) 0.182(DB00619) 0.168(METXBIODB00935)	0.282(CHEMBL3040018;­DBMET00025) 0.280(DBMET00360;­METXBIODB00684) 0.233(DBMET02815 )
MAP3K9 inhibitor	0.855(DB06595) 0.373(METXBIODB00724;­METXBIODB01778) 0.320(DB12332)	0.828(DBMET01441) 0.547(DBMET01440) 0.322(DBMET03519 )
Hypoglycemic	0.926(CHEMBL1770248;­DB11827) 0.923(DB01914;­DB09419;­DB11735) 0.917(METXBIODB00090;­METXBIODB03094)	0.995(METXBIODB00716) 0.934(CHEMBL3527603;­DBMET01906) 0.928(DBMET01300 )
Glutamate (mGluR) agonist	0.528(DB00347) 0.441(DB00339) 0.396(DB00799)	0.555(DBMET01139) 0.486(DBMET01005) 0.449(DBMET03065 )
Antiemetic	0.982(DB09291) 0.975(DB00673) 0.920(METXBIODB00037)	0.992(DBMET01398) 0.920(DBMET00349;­DBMET01590) 0.912(METXBIODB00038 )
Opioid kappa receptor agonist	0.990(DB00921) 0.957(METXBIODB01912) 0.908(METXBIODB03062)	0.957(DBMET00174) 0.885(DBMET00176) 0.834(METXBIODB02676 )
Insulin growth factor antagonist	0.996(DB12267) 0.265(DB05294) 0.259(DB11986)	0.269(DBMET02094) 0.243(CHEMBL941) 0.236(DBMET02095 )
Antiviral (RSV)	0.331(DB00709) 0.297(DB14761) 0.277(DB00879)	0.371(DB11100) 0.351(DBMET00899) 0.320(DBMET00898 )
MAP kinase kinase 8 inhibitor	0.193(DB00730) 0.135(DB11763) 0.127(METXBIODB00935)	0.292(DB00166) 0.287(CHEMBL3186899) 0.235(DB06457 )
Kallikrein 1 inhibitor	0.499(CHEMBL169901;­DB04840) 0.189(METXBIODB01173) 0.159(DB13729)	0.475(DBMET03379) 0.452(DBMET03378) 0.298(CHEMBL3527068 )
Phosphodiesterase XI inhibitor	0.750(DB00862) 0.695(DB00820) 0.259(DB01058)	0.759(DBMET03640) 0.695(DBMET03416) 0.293(CHEMBL3526358 )
Phosphodiesterase 11A inhibitor	0.750(DB00862) 0.695(DB00820) 0.259(DB01058)	0.759(DBMET03640) 0.695(DBMET03416) 0.293(CHEMBL3526358 )
Amyloid beta precursor protein antagonist	0.862(DB06799) 0.712(DB00712;­DB05289;­METXBIODB00141;­METXBIODB02725) 0.696(METXBIODB03069)	0.731(DBMET01434) 0.710(DBMET00155;­METXBIODB00136;­METXBIODB01971) 0.696(DBMET00151;­DBMET01566;­METXBIODB00142 )
Leukotriene A4 hydrolase inhibitor	0.811(DB01197) 0.644(DB06151) 0.399(METXBIODB00328)	0.706(DBMET00803) 0.623(DBMET00508) 0.608(DBMET00503 )
Thrombin inhibitor	0.806(CHEMBL169901;­DB04840) 0.415(DB00188) 0.397(DB06695)	0.672(METXBIODB00590) 0.614(CHEMBL3527068) 0.585(CHEMBL1710849;­DBMET01641 )
Topoisomerase I inhibitor	0.979(METXBIODB02544) 0.851(DB00762;­METXBIODB00933) 0.752(DB09117)	0.979(DBMET01143) 0.875(METXBIODB02545) 0.761(DBMET01681;­METXBIODB00934 )
Glucagon agonist	0.023(DB00130) 0.017(DB11296) 0.014(METXBIODB00189)	0.073(CHEMBL3706506;­DBMET01110) 0.063(DBMET00506) 0.040(DBMET01483 )
HCV NS5A inhibitor	0.082(DB11978) 0.061(DB11703) 0.050(CHEMBL385517;­DB06335)	0.086(DBMET02889) 0.078(DBMET03658) 0.061(DBMET02884 )
Vasopressin 1 antagonist	0.693(DB01744;­DB11345;­METXBIODB01913) 0.643(DB09059) 0.562(CHEMBL49429)	0.378(CHEMBL237772) 0.341(CHEMBL3246317;­DBMET00112) 0.317(DBMET00396 )
Protein-tyrosine phosphatase inhibitor	0.767(METXBIODB01081) 0.734(CHEMBL820) 0.659(METXBIODB02871)	0.745(METXBIODB00356) 0.722(DBMET01434) 0.714(METXBIODB02931 )
5 Hydroxytryptamine agonist	0.911(DB13345) 0.905(METXBIODB01229) 0.885(METXBIODB01680)	0.992(CHEMBL3526304) 0.954(METXBIODB01682) 0.905(DBMET01732;­DBMET01825;­METXBIODB01849 )
Antineurogenic pain	0.958(DB00909;­DB01221;­DB11823;­METXBIODB00118) 0.939(METXBIODB01177) 0.915(METXBIODB01179;­METXBIODB01881)	0.980(DBMET00189;­DBMET01310;­METXBIODB00119) 0.965(DBMET00190;­DBMET01309) 0.962(DBMET01308 )
EphB4 antagonist	0.678(CHEMBL554) 0.677(METXBIODB00866) 0.647(DB05294)	0.678(CHEMBL3526614;­CHEMBL3526615) 0.599(CHEMBL3527095) 0.579(METXBIODB00868 )
Lck kinase inhibitor	0.662(DB01254) 0.561(DB00575) 0.559(DB08864)	0.816(CHEMBL244377) 0.766(CHEMBL1231106) 0.742(DBMET03622 )
Granulocyte macrophage colony stimulating factor antagonist	0.546(DB00619) 0.469(DB12267) 0.355(DB06616)	0.559(DBMET00028) 0.546(CHEMBL941) 0.516(DBMET03528 )
Heme oxygenase stimulant	0.222(METXBIODB01177) 0.194(METXBIODB01179;­METXBIODB01881) 0.193(METXBIODB01879)	0.531(CHEMBL3706457) 0.196(DBMET02110) 0.194(DBMET00888 )
Tyrosine-protein kinase receptor antagonist	0.511(DB06595) 0.507(DB08865) 0.453(DB08877)	0.469(DBMET03537) 0.445(DBMET02020) 0.404(DBMET02094 )
Cushing's syndrome treatment	0.983(DB00648) 0.906(DB01011) 0.777(DB00834)	0.757(METXBIODB02005) 0.717(DBMET01703) 0.673(DBMET01704 )
Amyloid beta aggregation inhibitor	0.954(METXBIODB02376) 0.933(METXBIODB02142) 0.914(METXBIODB02170)	0.958(DB12243) 0.943(DBMET01757) 0.942(METXBIODB03144 )
Phosphodiesterase 7B inhibitor	0.450(METXBIODB02126) 0.447(DB01029;­METXBIODB00929) 0.442(METXBIODB02380)	0.491(METXBIODB01626) 0.432(DBMET01057) 0.419(DBMET01053;­METXBIODB00932 )
Complement C5a chemotactic receptor antagonist	0.184(DB01429) 0.140(DB01591) 0.130(METXBIODB00295)	0.201(CHEMBL3527154) 0.167(DBMET01811) 0.124(DBMET01810 )
Hepatocyte growth factor antagonist	0.780(DB08865) 0.541(CHEMBL377300) 0.316(CHEMBL270995)	0.698(DBMET03537) 0.632(CHEMBL3526252) 0.631(CHEMBL380905 )
Factor III inhibitor	0.180(METXBIODB02767) 0.168(METXBIODB02294) 0.157(DB14186)	0.234(DBMET01180;­METXBIODB02015) 0.173(DBMET01535) 0.157(METXBIODB00460 )
Telomerase inhibitor	0.556(METXBIODB02879) 0.543(CHEMBL58) 0.520(METXBIODB02877)	0.998(METXBIODB00716) 0.765(METXBIODB01596) 0.623(DBMET00513 )
Insulin receptor antagonist	0.970(DB12267) 0.490(DB11986) 0.336(DB00619)	0.336(CHEMBL941) 0.280(CHEMBL3040018;­DBMET00025) 0.274(DBMET02746 )
Purinergic P2Y1 antagonist	0.145(DB00242) 0.069(DB06716) 0.066(DB00631)	0.298(DBMET00677) 0.245(DBMET02089) 0.241(DBMET00419 )
Factor XIa inhibitor	0.136(CHEMBL169901;­DB04840) 0.128(DB00356) 0.126(DB01202)	0.689(CHEMBL3527402) 0.316(METXBIODB00936) 0.148(DBMET00166 )
Antibiotic Naphthyridine-like	0.956(DB01155) 0.850(DB00685;­METXBIODB02642) 0.170(DB00537)	0.600(DBMET00922) 0.364(METXBIODB02643) 0.144(DBMET02516 )
Growth hormone secretagogue receptor antagonist	0.894(DB00191) 0.215(METXBIODB01087) 0.155(DB01255)	0.766(DBMET02227) 0.476(DB01365) 0.282(CHEMBL1231106 )
Cell adhesion molecule inhibitor	0.497(METXBIODB01514) 0.445(DB00731) 0.432(METXBIODB00029)	0.696(DBMET02880) 0.545(DBMET02881) 0.544(CHEMBL3544550 )
Retinoic acid alpha receptor agonist	0.798(DB06755) 0.788(DB00755;­DB00982;­METXBIODB00937) 0.771(METXBIODB01691)	0.788(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.756(DBMET03633) 0.701(DBMET00453 )
Cyclin E1 inhibitor	0.228(DB09073) 0.170(METXBIODB03012) 0.159(CHEMBL58)	0.570(DBMET02996) 0.384(METXBIODB01432) 0.276(DBMET02378 )
Opioid agonist	0.995(DB00921) 0.993(METXBIODB01912) 0.962(METXBIODB03062)	0.993(DBMET00174) 0.958(DBMET00176) 0.954(DBMET00424 )
HIV-1 integrase (3'-Processing) inhibitor	0.780(METXBIODB02351) 0.678(METXBIODB02170) 0.649(METXBIODB01964)	0.825(CHEMBL1176) 0.744(DBMET03078) 0.739(METXBIODB02254 )
NMDA 2B receptor antagonist	0.686(DB00356) 0.669(DB01221;­DB11823;­METXBIODB00118) 0.656(DB09343)	0.734(METXBIODB02506) 0.674(DBMET01411) 0.673(DBMET02101 )
Neutropenia treatment	0.412(METXBIODB01691) 0.382(DB00242) 0.357(CHEMBL64391;­DB01167;­METXBIODB00524)	0.421(CHEMBL3526890) 0.357(CHEMBL4525087;­CHEMBL4525088) 0.331(METXBIODB01692;­METXBIODB01693 )
Smo receptor antagonist	0.449(DB01026) 0.320(DB08828) 0.275(DB11932)	0.527(DBMET02668) 0.508(DBMET00827) 0.458(DBMET02651 )
CXC chemokine 3 receptor agonist	0.031(DB00730) 0.014(METXBIODB00628) 0.006(METXBIODB00070)	0.023(DBMET01768) 0.012(CHEMBL3544803) 0.010(METXBIODB00629 )
Antidiuretic hormone antagonist	0.673(DB09059) 0.618(CHEMBL49429) 0.586(DB01744;­DB11345;­METXBIODB01913)	0.632(CHEMBL237772) 0.403(CHEMBL3526965) 0.289(CHEMBL392363 )
Renal failure treatment	0.896(DB15456) 0.802(CHEMBL1639) 0.730(CHEMBL1393;­DB00421)	0.896(DBMET03244;­DBMET03245) 0.881(DBMET01540) 0.798(CHEMBL3507699 )
Integrin beta7 antagonist	0.591(METXBIODB00029) 0.291(METXBIODB02016;­METXBIODB02571) 0.118(METXBIODB00253)	0.552(METXBIODB00030) 0.248(METXBIODB02018) 0.192(METXBIODB02017 )
Growth hormone secretagogue receptor agonist	0.198(DB00191) 0.134(DB00216) 0.120(METXBIODB00010)	0.189(DBMET00088) 0.144(DBMET03226) 0.142(DBMET00081 )
Cyclin E inhibitor	0.578(CHEMBL104) 0.219(DB09073) 0.188(CHEMBL58)	0.503(DBMET02996) 0.329(METXBIODB01432) 0.257(DBMET02378 )
MAP kinase 11 inhibitor	0.757(METXBIODB00513) 0.332(DB13228) 0.260(DB12245)	0.776(METXBIODB00515) 0.584(METXBIODB00514) 0.396(CHEMBL3544872;­CHEMBL457723 )
Factor IX inhibitor	0.039(METXBIODB00207;­METXBIODB01680) 0.037(METXBIODB00562) 0.035(METXBIODB00957)	0.049(METXBIODB01681) 0.048(DBMET03379;­METXBIODB01682) 0.046(DBMET02165 )
Sepsis treatment	0.732(DB02703) 0.720(DB01221;­DB11823;­METXBIODB00118) 0.712(DB06590)	0.734(DBMET03082) 0.673(DBMET00191) 0.671(DBMET03096 )
5 Hydroxytryptamine uptake inhibitor	0.968(METXBIODB01237) 0.951(DB00245) 0.945(METXBIODB00739)	0.970(METXBIODB01238) 0.948(DBMET02260) 0.945(DBMET00086 )
O6-alkylguanine-DNA alkyltransferase inhibitor	0.694(DB02377) 0.194(DB00352) 0.135(DB01280)	0.823(DBMET03666) 0.231(DBMET00493) 0.153(CHEMBL226396 )
mTOR complex 1 inhibitor	0.981(CHEMBL413;­DB00877;­METXBIODB01375) 0.974(METXBIODB00817) 0.960(DB06287)	0.981(DBMET00628;­METXBIODB00818) 0.980(CHEMBL3544651;­DBMET00389;­DBMET01748;­METXBIODB01376) 0.978(CHEMBL3544688;­DBMET01749;­METXBIODB01377 )
Endometrios treatment	0.918(DB00717) 0.911(METXBIODB03119) 0.905(CHEMBL1201146)	0.953(DBMET01496) 0.930(DBMET01495) 0.918(CHEMBL1162 )
Prostate cancer treatment	0.934(DB08899) 0.897(DB06755) 0.893(DB05109;­DB06176)	0.942(DBMET03550;­DBMET03551) 0.912(DBMET03549) 0.906(DBMET01580 )
Glucagon-like peptide 1 agonist	0.169(DB11296) 0.151(DB00130) 0.132(DB09059)	0.990(METXBIODB01388) 0.753(METXBIODB00485) 0.191(DBMET01483 )
Neuropeptide Y5 antagonist	0.271(METXBIODB01731) 0.177(METXBIODB01085) 0.136(DB00414)	0.397(METXBIODB01732) 0.166(METXBIODB01086) 0.162(CHEMBL3706536 )
Dysmenorrhea treatment	0.537(METXBIODB02451) 0.511(CHEMBL661;­DB00404) 0.499(DB00897)	0.537(DBMET00862) 0.518(METXBIODB00890) 0.508(DBMET01082;­DBMET01084;­DBMET01085;­DBMET01086 )
Antibiotic Carbacephem-like	0.051(DB00493) 0.050(DB01413) 0.036(DB06590)	0.024(DBMET00646) 0.020(DBMET03002) 0.019(DBMET03001 )
Glutamate (mGluR group I) antagonist	0.493(DB00799) 0.252(METXBIODB01030) 0.245(METXBIODB01893)	0.507(DBMET01005) 0.317(DB14028;­DBMET00831) 0.275(METXBIODB00629 )
Antimigraine	0.989(DB13345) 0.983(METXBIODB00475) 0.974(METXBIODB00369)	0.983(METXBIODB00476) 0.981(DBMET02090;­METXBIODB00477) 0.974(METXBIODB00370 )
Opioid delta receptor agonist	0.988(DB00921) 0.979(METXBIODB01912) 0.931(DB00704)	0.979(DBMET00174) 0.953(DBMET00424) 0.929(DBMET00321;­METXBIODB01140 )
MAP kinase kinase 3 inhibitor	0.667(DB06595) 0.446(DB00339) 0.387(DB06728)	0.607(DBMET01440) 0.593(DBMET01441) 0.490(DBMET00376 )
Multidrug resistance-associated protein 1 inhibitor	0.417(METXBIODB02273) 0.393(DB00580) 0.381(METXBIODB02879)	0.398(DBMET01340;­DBMET01341) 0.381(CHEMBL3526945;­CHEMBL3527008) 0.379(METXBIODB02274;­METXBIODB02275 )
Calcitonin gene-related peptide antagonist	0.177(METXBIODB01350) 0.159(DB01184) 0.134(CHEMBL16;­DB00252)	0.893(METXBIODB01351) 0.148(METXBIODB01184) 0.134(DBMET01170 )
Antinephritic	0.669(DB01914;­DB09419;­DB11735) 0.601(CHEMBL3542194) 0.559(DB01656)	0.654(CHEMBL3542345) 0.613(CHEMBL3542195) 0.612(CHEMBL3542317 )
CXC chemokine 4 receptor antagonist	0.358(DB06824) 0.353(METXBIODB01173) 0.323(DB00592)	0.362(DBMET01778) 0.324(DBMET01959) 0.303(DBMET00502;­DBMET00840 )
Antiallergic	0.995(CHEMBL1473;­DB00588;­DB08906) 0.993(METXBIODB01531) 0.992(DB00764)	0.993(DBMET03675) 0.992(DBMET02361) 0.991(CHEMBL3542318;­DBMET02591 )
Sleep disorders treatment	0.956(DB09034) 0.896(CHEMBL1373;­DB00745) 0.863(DB00402;­DB01198;­METXBIODB02096)	0.869(CHEMBL3527303) 0.857(DBMET00300) 0.843(DBMET00135;­DBMET00299;­METXBIODB00791 )
Nicotinic receptor alpha4 subunit antagonist	0.934(METXBIODB00904) 0.866(DB11421) 0.701(DB01156;­METXBIODB00109;­METXBIODB01854)	0.975(DBMET03469;­DBMET03471) 0.908(METXBIODB00906) 0.768(METXBIODB00905 )
Glutamate (mGluR) antagonist	0.496(DB00799) 0.414(DB12466) 0.400(DB00339)	0.564(CHEMBL3544524) 0.517(DBMET01005) 0.322(DBMET03125 )
DNA topoisomerase IV inhibitor	0.444(DB01155) 0.387(DB01044) 0.376(DB00685;­METXBIODB02642)	0.463(DBMET00451) 0.376(DBMET00434) 0.343(DBMET01098 )
Phosphodiesterase inhibitor	0.933(METXBIODB01645) 0.845(DB00922) 0.844(DB00862)	0.954(DBMET00997) 0.882(METXBIODB01646) 0.852(DBMET03640 )
MAP kinase 14 inhibitor	0.793(METXBIODB00513) 0.297(DB12245) 0.294(METXBIODB00935)	0.791(METXBIODB00515) 0.630(METXBIODB00514) 0.619(METXBIODB01222 )
Alpha tubulin antagonist	0.806(DB00773;­METXBIODB00808) 0.744(METXBIODB02619) 0.701(METXBIODB02212)	0.827(METXBIODB00687) 0.819(DBMET00367;­DBMET01264;­METXBIODB00809) 0.763(DBMET01265 )
Aurora-B kinase inhibitor	0.436(METXBIODB01487) 0.383(METXBIODB00866) 0.362(DB00619)	0.462(DBMET02094) 0.443(DBMET03650) 0.438(METXBIODB01489 )
Gonadotropin-releasing hormone receptor antagonist	0.534(DB01011) 0.184(CHEMBL1741;­DB01211;­METXBIODB00619) 0.171(CHEMBL532;­DB00199)	0.152(CHEMBL2022715;­DBMET00357;­METXBIODB00621) 0.144(CHEMBL3526373) 0.142(DBMET00909 )
Antineoplastic enhancer	0.978(DB06799) 0.973(DB06595) 0.955(DB09343)	0.992(DBMET01459) 0.987(DBMET01440) 0.974(DBMET01441 )
Caspase 3 stimulant	0.879(CHEMBL252915;­CHEMBL43469;­METXBIODB02982) 0.868(METXBIODB00685) 0.834(CHEMBL622;­DB00749;­METXBIODB00052;­METXBIODB02522)	0.904(DBMET01630;­METXBIODB00604) 0.883(METXBIODB00859) 0.879(CHEMBL4525081;­CHEMBL4525082;­CHEMBL4525083;­CHEMBL4525084 )
Catenin beta inhibitor	0.792(CHEMBL622;­DB00749;­METXBIODB00052;­METXBIODB02522) 0.465(DB01250) 0.414(CHEMBL1455)	0.777(CHEMBL873;­DBMET00148;­METXBIODB00053) 0.767(CHEMBL875;­DBMET00149;­METXBIODB00054) 0.742(CHEMBL874 )
Antibiotic Oxazolidinone-like	0.765(DB00601) 0.058(DB09042) 0.007(DB00614)	0.192(DBMET03356) 0.152(CHEMBL1207) 0.137(DBMET03355 )
Bromodomain-containing protein 3 inhibitor	0.264(CHEMBL661;­DB00404) 0.243(DB00897) 0.224(DB09166;­METXBIODB00801)	0.233(DBMET02821) 0.220(CHEMBL1313;­DBMET00348) 0.208(DBMET00395 )
Somatostatin 2 agonist	0.341(DB01074;­METXBIODB00067) 0.142(METXBIODB01792) 0.077(METXBIODB00228)	0.161(DBMET03446) 0.105(DBMET00088) 0.103(DBMET00839;­DBMET00914;­DBMET01547;­METXBIODB00068;­METXBIODB00069 )
Geranylgeranyltransferase I inhibitor	0.220(DB01085;­METXBIODB01181) 0.184(METXBIODB02568;­METXBIODB02799) 0.166(CHEMBL104)	0.289(DBMET00376) 0.267(DBMET03745) 0.241(DBMET00503 )
Mannitol 2-dehydrogenase inhibitor	0.771(DB00742;­DB11195) 0.422(DB01914;­DB09419;­DB11735) 0.036(DB00874;­DB06716)	0.952(DB03947) 0.906(DBMET03077) 0.597(DBMET03075 )
Cyclin-dependent kinase 3 inhibitor	0.610(DB06595) 0.371(CHEMBL817) 0.358(DB00580)	0.557(DBMET01440) 0.543(DBMET01441) 0.520(CHEMBL804;­DBMET00977 )
Factor VIIa inhibitor	0.347(CHEMBL169901;­DB04840) 0.187(METXBIODB01173) 0.151(DB01018)	0.653(CHEMBL3544523) 0.313(DBMET03379) 0.265(CHEMBL3544524 )
Antineoplastic (lymphocytic leukemia)	0.988(DB00526) 0.883(METXBIODB02420) 0.848(DB00773;­METXBIODB00808)	0.994(DBMET03683) 0.969(DBMET02075) 0.939(CHEMBL913;­DBMET01125 )
Aldose reductase inhibitor	0.595(CHEMBL16;­DB00252) 0.495(METXBIODB02879) 0.458(METXBIODB02365)	0.700(DBMET01300) 0.650(DBMET01365) 0.595(DBMET01170 )
Factor X inhibitor	0.881(DB12364) 0.770(CHEMBL169901;­DB04840) 0.567(CHEMBL1269025)	0.979(DBMET01535) 0.885(DBMET01533) 0.541(CHEMBL3526352 )
Chemokine receptor antagonist	0.923(DB06652) 0.541(DB00836) 0.506(METXBIODB00192)	0.972(DBMET00080) 0.964(DBMET00081;­DBMET00083) 0.953(DBMET00078 )
VLA-4 antagonist	0.798(METXBIODB00029) 0.270(METXBIODB02016;­METXBIODB02571) 0.202(DB00731)	0.760(METXBIODB00030) 0.280(DBMET01064) 0.214(METXBIODB02018 )
Retinoic acid beta receptor antagonist	0.903(METXBIODB01691) 0.893(DB00755;­DB00982;­DB06755;­METXBIODB00937) 0.671(METXBIODB00323;­METXBIODB01252)	0.893(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.856(DBMET03633) 0.796(DBMET00453 )
Farnesyltransferase inhibitor	0.875(DB06448) 0.459(DB01085;­METXBIODB01181) 0.333(METXBIODB02681)	0.887(DBMET03218) 0.864(DBMET03217) 0.465(DBMET00506 )
Activin receptor-like kinase 4 inhibitor	0.482(METXBIODB01020) 0.450(METXBIODB00935) 0.395(DB06595)	0.302(METXBIODB01022) 0.278(CHEMBL724;­DBMET00354;­DBMET03729;­METXBIODB00201) 0.275(DBMET01440 )
Protein kinase C epsilon inhibitor	0.982(DB06595) 0.287(METXBIODB01288) 0.199(DB06637)	0.983(DBMET01440) 0.956(DBMET01441) 0.257(METXBIODB01289 )
Substance P antagonist	0.951(METXBIODB00820) 0.928(DB00673) 0.918(METXBIODB00616)	0.918(METXBIODB00821) 0.901(METXBIODB00822) 0.886(METXBIODB00618 )
Calcitonin gene-related peptide 1 receptor antagonist	0.260(METXBIODB01350) 0.178(DB01184) 0.165(METXBIODB00747)	0.226(METXBIODB01184) 0.159(DBMET00364;­METXBIODB00749) 0.138(METXBIODB00748 )
Complement factor 1r inhibitor	0.098(METXBIODB02449) 0.082(METXBIODB02611) 0.075(METXBIODB02370)	0.047(DBMET01492) 0.046(CHEMBL3526371;­DBMET00468) 0.043(METXBIODB02371 )
Excitatory amino acid transporter 4 inhibitor	0.025(DB00130) 0.024(DB00129) 0.021(METXBIODB00858;­METXBIODB01659)	0.042(DBMET02241) 0.037(METXBIODB01660) 0.031(DB00142 )
Glycine transporter 1 inhibitor	0.343(METXBIODB01170) 0.250(DB00215;­DB01175) 0.220(DB00472;­DB08472;­DB08544;­METXBIODB01953)	0.872(CHEMBL3526350) 0.501(CHEMBL3526349) 0.242(DB02083 )
VCAM antagonist	0.263(METXBIODB01224) 0.260(METXBIODB00207) 0.239(METXBIODB00029)	0.274(METXBIODB01225) 0.271(METXBIODB01226) 0.206(METXBIODB00030 )
Glutamate (mGluR5) antagonist	0.456(DB00799) 0.195(DB00829) 0.179(METXBIODB01893)	0.477(DBMET01005) 0.235(METXBIODB00629) 0.199(DB14028;­DBMET00831 )
HIV-1 integrase (Strand Transfer) inhibitor	0.655(METXBIODB02351) 0.640(METXBIODB02170) 0.603(METXBIODB03100)	0.800(DBMET03078) 0.628(CHEMBL1176) 0.625(METXBIODB02254 )
Acid-sensing ion channel blocker	0.567(METXBIODB00230) 0.136(METXBIODB01620) 0.104(METXBIODB02739)	0.237(METXBIODB00231) 0.124(CHEMBL3527278) 0.092(DBMET03015 )
VCAM-1 antagonist	0.262(METXBIODB01224) 0.258(METXBIODB00207) 0.236(METXBIODB00029)	0.273(METXBIODB01225) 0.269(METXBIODB01226) 0.204(METXBIODB00030 )
Antineoplastic (cervical cancer)	0.915(DB00361) 0.892(METXBIODB00685) 0.890(DB00570)	0.910(DBMET02029) 0.884(METXBIODB00686;­METXBIODB00687) 0.871(DBMET01263 )
CDK2/cyclin E2 inhibitor	0.268(CHEMBL1308;­DB01213) 0.211(METXBIODB03014) 0.203(CHEMBL585;­DB00384)	0.313(CHEMBL3526813) 0.224(METXBIODB00380) 0.207(DBMET03271 )
Transforming growth factor beta 3 antagonist	0.779(DB11640) 0.238(DB06637) 0.154(METXBIODB00935)	0.281(DBMET02179) 0.204(DBMET02177) 0.198(DBMET02650 )
HDL-cholesterol increasing	0.644(DB01579) 0.605(DB09282) 0.458(METXBIODB02451)	0.503(CHEMBL3544523) 0.500(METXBIODB01325) 0.458(DBMET00862 )
Neurokinin antagonist	0.974(DB00673) 0.943(METXBIODB00820) 0.940(METXBIODB00037)	0.976(DBMET01398) 0.940(DBMET00349;­DBMET01590) 0.888(METXBIODB00821 )
Antiosteoporotic	0.966(METXBIODB02719) 0.965(DB06670) 0.963(CHEMBL846;­DB00136)	0.975(DBMET02435) 0.966(DBMET02434) 0.953(CHEMBL3544529;­DBMET00575 )
Cell adhesion inhibitor	0.528(DB00731) 0.518(METXBIODB00029) 0.516(CHEMBL3542194)	0.573(DBMET02880) 0.565(CHEMBL3526604) 0.538(DBMET01477 )
Follicle-stimulating hormone antagonist	0.170(CHEMBL49429) 0.040(METXBIODB02458) 0.036(METXBIODB00244)	0.166(CHEMBL3526411) 0.100(CHEMBL3544832) 0.097(DBMET01341 )
Dependence treatment	0.965(DB00921) 0.955(DB00704) 0.948(DB01192)	0.948(DBMET00321;­METXBIODB01140) 0.947(DBMET00174) 0.926(DBMET00760 )
Factor VII inhibitor	0.117(METXBIODB01173) 0.107(DB00669) 0.092(CHEMBL169901;­DB04840)	0.187(DBMET03379) 0.166(DBMET01535) 0.161(DBMET03378 )
Restenosis treatment	0.929(METXBIODB02556) 0.917(CHEMBL1111;­DB06403) 0.895(CHEMBL413;­DB00877;­METXBIODB01375)	0.915(CHEMBL3706461) 0.895(DBMET00628;­METXBIODB00818) 0.894(CHEMBL3544651;­DBMET00389;­DBMET01748;­METXBIODB01376 )
Urotensin II antagonist	0.533(DB05676) 0.055(CHEMBL455136) 0.036(METXBIODB02615)	0.400(DBMET01392) 0.240(DBMET00900) 0.070(DBMET02625 )
DNA intercalator	0.975(DB09117) 0.962(CHEMBL1117) 0.960(CHEMBL417;­CHEMBL53463;­DB00997)	0.976(DBMET00513) 0.936(DBMET00952) 0.933(DBMET01143 )
MAP kinase kinase 4 inhibitor	0.833(DB08881) 0.604(DB06595) 0.564(METXBIODB02518)	0.722(DBMET01856) 0.710(DBMET01854) 0.516(DBMET01441 )
5 Hydroxytryptamine 2C agonist	0.848(METXBIODB01229) 0.845(DB00592) 0.795(DB04871)	0.983(CHEMBL3526304) 0.848(DBMET01732;­DBMET01825;­METXBIODB01849) 0.681(METXBIODB01885 )
Bradykinin B2 receptor agonist	0.117(METXBIODB01731) 0.067(METXBIODB01173) 0.059(DB00129)	0.197(METXBIODB01732) 0.148(DBMET00502) 0.116(DBMET02067 )
Antidiabetic (type 1)	0.830(CHEMBL846;­DB00136) 0.773(DB06799) 0.768(DB00169)	0.805(DB00146) 0.800(CHEMBL3542380;­CHEMBL3542386) 0.796(CHEMBL3544529;­DBMET00575 )
Interleukin antagonist	0.960(CHEMBL1430) 0.733(DB06151) 0.662(CHEMBL1741;­CHEMBL532;­DB00199;­DB01211;­METXBIODB00619)	0.842(DBMET03115) 0.741(CHEMBL1379) 0.734(DBMET00503 )
Cyclin H inhibitor	0.132(DB08912) 0.107(DB09073) 0.096(DB06595)	0.179(CHEMBL244377) 0.131(DBMET03512) 0.128(CHEMBL574 )
Attention deficit/hyperactivity disorder treatment	0.935(METXBIODB01237) 0.903(DB01236) 0.863(DB12473)	0.932(METXBIODB01238) 0.885(METXBIODB01239;­METXBIODB01240) 0.847(DBMET01734;­DBMET01826;­METXBIODB01231;­METXBIODB01851 )
Antiarrhythmic	0.956(DB00373;­METXBIODB01469) 0.897(CHEMBL633;­DB01118) 0.883(DB04855)	0.901(METXBIODB01470) 0.897(CHEMBL4525130;­CHEMBL4525131;­CHEMBL4525132;­CHEMBL4525133;­CHEMBL4525134;­CHEMBL4525135;­CHEMBL4525136;­CHEMBL4525137;­CHEMBL4525138) 0.873(DBMET02840 )
Carnitine palmitoyltransferase 1B inhibitor	0.126(METXBIODB03147) 0.109(METXBIODB03148) 0.107(METXBIODB01859)	0.174(DB09269;­DBMET01431;­METXBIODB03146) 0.153(DBMET00688) 0.133(DBMET03556 )
Phosphodiesterase 10A inhibitor	0.309(DB00862) 0.190(CHEMBL512306) 0.182(DB01685;­METXBIODB02526)	0.335(DBMET03640) 0.261(DBMET02821) 0.238(CHEMBL3526547 )
Phosphodiesterase X inhibitor	0.309(DB00862) 0.190(CHEMBL512306) 0.182(DB01685;­METXBIODB02526)	0.335(DBMET03640) 0.261(DBMET02821) 0.238(CHEMBL3526547 )
ErbB-1 antagonist	0.879(DB00530) 0.848(METXBIODB02932) 0.841(METXBIODB03041)	0.840(DBMET01790) 0.807(CHEMBL3526326) 0.784(CHEMBL3526614;­CHEMBL3526615 )
Alpha 1b adrenoreceptor agonist	0.538(CHEMBL762;­DB00935) 0.519(METXBIODB02632) 0.484(DB04948)	0.538(CHEMBL4525123;­CHEMBL4525124) 0.472(CHEMBL3526775) 0.420(METXBIODB02633 )
MAP kinase 1 inhibitor	0.773(DB06616) 0.682(DB11763) 0.675(DB00619)	0.755(DBMET03737) 0.731(DBMET03736) 0.690(DBMET03650 )
Interleukin 1b antagonist	0.794(METXBIODB00458) 0.694(METXBIODB02142) 0.652(METXBIODB02140;­METXBIODB02144)	0.893(DBMET03115) 0.877(CHEMBL1207) 0.868(DBMET03181 )
MAP-kinase-activated kinase 5 inhibitor	0.735(DB06595) 0.514(DB09079) 0.422(CHEMBL413;­DB00877;­METXBIODB01375)	0.789(DBMET01440) 0.706(DBMET01441) 0.547(DBMET02778 )
T cell inhibitor	0.993(DB06697) 0.992(DB11638) 0.990(METXBIODB00454)	0.992(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.991(METXBIODB00455) 0.938(DBMET01913;­DBMET03143 )
Diabetic retinopathy treatment	0.982(DB00869) 0.981(DB00727) 0.891(CHEMBL1504)	0.986(DBMET03010) 0.981(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.863(CHEMBL3542337;­DBMET03671 )
MAP kinase kinase 5 inhibitor	0.557(DB06595) 0.453(DB09079) 0.371(DB06799)	0.503(DBMET01440) 0.488(DBMET01441) 0.462(DBMET02778 )
Ca2+/calmodulin-dependent kinase II beta inhibitor	0.814(DB06595) 0.804(METXBIODB01288) 0.520(DB12332)	0.949(DBMET01440) 0.788(METXBIODB01289) 0.781(DBMET01441 )
Bone diseases treatment	0.958(METXBIODB02719) 0.956(CHEMBL846;­DB00136) 0.950(DB00153;­METXBIODB01575;­METXBIODB02762)	0.964(DBMET02435) 0.958(DBMET02434) 0.955(METXBIODB01576 )
Antineoplastic (non-Hodgkin's lymphoma)	0.982(CHEMBL88;­DB00531;­METXBIODB00960) 0.942(DB12902;­METXBIODB00967) 0.936(DB06263)	0.982(DBMET01683) 0.957(CHEMBL3544546;­CHEMBL3706538;­DBMET01076) 0.955(CHEMBL731;­DBMET00019 )
M18 aspartyl aminopeptidase inhibitor	0.493(CHEMBL817) 0.477(DB01120) 0.468(METXBIODB01176)	0.486(CHEMBL1330852) 0.482(CHEMBL3544596) 0.481(CHEMBL1502560 )
Factor IXa inhibitor	0.131(METXBIODB00562) 0.129(DB00581) 0.122(METXBIODB00207)	0.439(DBMET02908) 0.285(METXBIODB02645) 0.265(METXBIODB02293 )
Carnitine palmitoyltransferase 1A inhibitor	0.186(DB05016) 0.081(DB00583) 0.069(DB06756)	0.068(DBMET01532) 0.057(DBMET02884) 0.056(DBMET02889 )
Src kinase inhibitor	0.743(DB06616) 0.696(DB01254) 0.625(DB08864)	0.753(DBMET03622) 0.744(CHEMBL244377) 0.732(DBMET03736 )
VEGFR2 expression inhibitor	0.159(DB00437) 0.150(DB00398) 0.123(CHEMBL1076347)	0.124(DBMET03578) 0.116(CHEMBL3526308) 0.103(CHEMBL380905 )
Integrin alpha4beta7 antagonist	0.803(METXBIODB00029) 0.260(METXBIODB02016;­METXBIODB02571) 0.193(DB00731)	0.756(METXBIODB00030) 0.257(DBMET01064) 0.209(METXBIODB02018 )
Aminoacyl-tRNA synthetase inhibitor	0.635(CHEMBL1430) 0.606(DB00410) 0.481(DB00640)	0.700(DB00171) 0.682(DBMET00769) 0.654(DBMET00677 )
Integrin alpha4 antagonist	0.763(METXBIODB00029) 0.356(DB00731) 0.289(METXBIODB02016;­METXBIODB02571)	0.674(METXBIODB00030) 0.402(DBMET01064) 0.287(DBMET01323;­DBMET01831 )
Transforming growth factor antagonist	0.432(METXBIODB01020) 0.392(DB00730) 0.254(DB11640)	0.266(DBMET02777) 0.259(DBMET02778) 0.254(METXBIODB01022 )
Chelator	0.844(CHEMBL1430) 0.769(METXBIODB02376) 0.722(CHEMBL1314;­DB06823)	0.739(DBMET01974) 0.715(DB02083) 0.699(CHEMBL3544531 )
MAP kinase 12 inhibitor	0.842(METXBIODB00513) 0.432(DB12245) 0.419(DB13228)	0.837(METXBIODB00515) 0.621(METXBIODB00514) 0.426(DBMET01440 )
Interleukin 12 antagonist	0.448(DB11638) 0.437(DB06697) 0.423(DB09274;­METXBIODB01712)	0.832(DBMET01117) 0.789(DBMET01116) 0.631(DBMET01115 )
Adrenaline antagonist	0.981(DB04948) 0.980(DB13345) 0.979(DB00373;­METXBIODB01469)	0.993(DBMET02990) 0.987(DBMET02229) 0.965(METXBIODB00476 )
Dual specificity tyrosine-phosphorylation-regulated kinase 4 inhibitor	0.877(DB00379;­DB07129;­METXBIODB01843) 0.634(DB00697;­METXBIODB02082) 0.475(METXBIODB00935)	0.973(DBMET03336) 0.958(DBMET03335) 0.812(DBMET00260;­DBMET01551;­METXBIODB01844 )
Antidiabetic symptomatic	0.943(DB00727) 0.871(DB00869) 0.825(DB01132)	0.943(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.906(DBMET01300) 0.903(DBMET03010 )
Antiadrenergic	0.982(DB04948) 0.980(DB13345) 0.979(DB00373;­METXBIODB01469)	0.993(DBMET02990) 0.988(DBMET02229) 0.965(METXBIODB00476 )
Systemic lupus erythematosus treatment	0.998(DB01294) 0.877(CHEMBL88;­DB00531;­METXBIODB00960) 0.738(DB16650)	0.877(DBMET01683) 0.748(DBMET03547) 0.684(CHEMBL3526246;­DBMET00092 )
MAP-kinase-activated kinase 2 inhibitor	0.340(DB12332) 0.307(METXBIODB00004) 0.301(DB00592)	0.359(DBMET03519) 0.357(DBMET03517) 0.330(DBMET03522 )
Antianginal	0.990(DB06154;­DB09282) 0.987(DB00727) 0.979(DB01020)	0.995(DB13400) 0.987(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.956(DBMET02011 )
Janus tyrosine kinase 1 inhibitor	0.544(DB08877) 0.482(DB11697) 0.381(DB14973)	0.543(DBMET03436) 0.478(DBMET03261) 0.443(DBMET03438 )
DNA helicase inhibitor	0.191(DB09167) 0.140(DB06737;­METXBIODB02093;­METXBIODB02934) 0.133(METXBIODB01099)	0.285(CHEMBL1529857) 0.243(CHEMBL3544654;­DBMET00378) 0.203(DBMET00219 )
Antiviral (Influenza)	0.987(DB13997) 0.916(DB00198) 0.873(DB12466)	0.991(DB15675) 0.924(DBMET02218) 0.674(DBMET03065 )
CDK2/cyclin A inhibitor	0.534(DB09073) 0.478(DB11697) 0.310(METXBIODB02929)	0.699(DBMET03436) 0.643(DBMET03666) 0.567(CHEMBL3526813 )
Glutamate receptor antagonist	0.852(DB01043) 0.697(DB01221;­DB11823;­METXBIODB00118) 0.685(DB00356)	0.675(CHEMBL3544524) 0.642(DBMET01818) 0.585(DBMET00189;­METXBIODB00119 )
Antipsychotic	0.982(DB08815) 0.977(DB08922;­METXBIODB02106) 0.962(DB00246)	0.989(DBMET00890;­DBMET02989;­METXBIODB01765) 0.985(DBMET01502;­METXBIODB02109) 0.980(DBMET02990 )
MAP kinase 10 inhibitor	0.420(METXBIODB03012) 0.335(METXBIODB00513) 0.259(METXBIODB02395)	0.540(CHEMBL3544805) 0.420(DBMET01043) 0.262(DBMET03650 )
Inosine monophosphate dehydrogenase 1 inhibitor	0.765(DB01024;­METXBIODB01063) 0.560(DB00688) 0.115(DB00640)	0.770(DBMET00767;­METXBIODB01064) 0.765(DBMET02606) 0.567(DBMET00662 )
Interleukin 1 antagonist	0.782(METXBIODB00458) 0.688(DB00605) 0.685(METXBIODB02142)	0.892(DBMET03115) 0.873(CHEMBL1207) 0.853(CHEMBL3526764;­DBMET03181 )
Ca(v)2.2 blocker	0.565(DB00737) 0.558(DB00568;­METXBIODB00600) 0.529(DB04841)	0.649(DBMET01193;­METXBIODB00603) 0.624(DBMET01197) 0.450(DBMET02577 )
Platelet activating factor antagonist	0.974(METXBIODB00481) 0.967(DB09166;­METXBIODB00801) 0.897(DB00897)	0.958(METXBIODB00483) 0.943(METXBIODB00802) 0.942(DBMET01525;­METXBIODB00803 )
Alzheimer's disease treatment	0.976(DB01236) 0.942(DB00185;­METXBIODB00507) 0.913(METXBIODB02903)	0.968(CHEMBL3526601) 0.942(DBMET00430;­DBMET00431;­DBMET00433) 0.940(METXBIODB01596 )
EphB2 antagonist	0.861(DB06595) 0.671(DB12874) 0.668(DB01033)	0.774(METXBIODB00515) 0.770(DBMET01440) 0.755(DBMET01441 )
Protocollagen prolyl hydroxylase inhibitor	0.750(DB12255) 0.747(DB04847) 0.596(DB11682)	0.706(DBMET03433) 0.564(DBMET00507) 0.503(DBMET02630 )
Neurokinin 1 antagonist	0.976(DB00673) 0.953(METXBIODB00820) 0.952(METXBIODB00037)	0.982(DBMET01398) 0.952(DBMET00349;­DBMET01590) 0.905(METXBIODB00821 )
c-Src kinase inhibitor	0.736(DB06616) 0.577(DB12267) 0.572(METXBIODB01339)	0.719(DBMET03736) 0.625(DBMET03737) 0.601(CHEMBL3544806 )
Potassium channel large-conductance Ca-activated activator	0.920(METXBIODB02793) 0.646(DB06756) 0.622(DB06716)	0.785(METXBIODB02794) 0.700(DBMET01338) 0.668(DBMET01342 )
MAP-kinase-activated kinase inhibitor	0.374(DB12332) 0.337(METXBIODB00004) 0.333(DB00592)	0.397(DBMET03519) 0.392(DBMET03517) 0.363(DBMET03522 )
Ca2+/calmodulin-dependent kinase II alpha inhibitor	0.935(DB06595) 0.767(METXBIODB01288) 0.663(DB08877)	0.959(DBMET01440) 0.918(DBMET01441) 0.728(METXBIODB01289 )
Antineoplastic (renal cancer)	0.880(DB11638) 0.874(DB06697) 0.844(METXBIODB02420)	0.903(CHEMBL525;­DBMET01147) 0.902(CHEMBL3706540;­DBMET01123) 0.880(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713 )
Antineoplastic (multiple myeloma)	0.960(CHEMBL88;­DB00531;­METXBIODB00960) 0.933(DB12902;­METXBIODB00967) 0.920(DB00188)	0.960(DBMET01683) 0.927(CHEMBL3706538) 0.912(CHEMBL3544546;­DBMET01076 )
Tumour necrosis factor alpha release inhibitor	0.938(DB05676) 0.850(DB00400) 0.830(DB00480)	0.963(CHEMBL1207) 0.928(DBMET01392) 0.914(DBMET02625 )
SULT1E1 substrate	0.774(DB09268) 0.732(DB04574) 0.558(DB00481;­METXBIODB01232)	0.927(DBMET02101) 0.896(METXBIODB02254) 0.880(CHEMBL1208633 )
Tryptophan hydroxylase 1 inhibitor	0.902(DB12095) 0.180(DB01235) 0.131(DB13848)	0.971(DBMET03552) 0.866(DBMET03553) 0.809(DBMET03554 )
Antineoplastic (breast cancer)	0.972(CHEMBL383824) 0.956(CHEMBL428647;­CHEMBL92;­DB01229;­DB01248) 0.953(DB06772)	0.981(CHEMBL87658;­DBMET00020;­DBMET00021;­METXBIODB00961;­METXBIODB00964) 0.969(CHEMBL3526785) 0.961(CHEMBL3526786;­CHEMBL3527105 )
Estradiol 17 beta-dehydrogenase 2 inhibitor	0.374(DB00870;­METXBIODB02067) 0.330(METXBIODB00207) 0.319(DB04831;­METXBIODB01466)	0.489(METXBIODB00024) 0.301(METXBIODB01345) 0.298(DBMET00163;­METXBIODB02069 )
Antipsoriatic	0.985(CHEMBL846;­DB00136) 0.980(METXBIODB03098) 0.978(METXBIODB02719)	0.989(DBMET02435;­METXBIODB01576) 0.978(DBMET02434) 0.975(CHEMBL3542380;­CHEMBL3542386 )
Myocardial ischemia treatment	0.993(DB06154) 0.992(DB09282) 0.989(DB00727)	0.995(DB13400) 0.989(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.962(DBMET02011 )
DNA gyrase subunit A inhibitor	0.422(DB01155) 0.365(DB01044) 0.188(DB00537)	0.478(DBMET00451) 0.421(DBMET00434) 0.361(DBMET01098 )
Myc inhibitor	0.140(DB00592) 0.125(DB00330) 0.093(DB04871)	0.406(CHEMBL3526354) 0.138(DBMET00095) 0.136(CHEMBL3550090 )
Breast cancer-resistant protein inhibitor	0.808(CHEMBL1370;­DB01222;­METXBIODB01745) 0.788(METXBIODB00461) 0.768(METXBIODB01409)	0.798(CHEMBL3542395;­DBMET00476;­METXBIODB01746) 0.796(CHEMBL3542373;­DBMET02914) 0.766(METXBIODB00463 )
Cachexia treatment	0.555(DB05676) 0.526(CHEMBL1272;­DB00912) 0.438(METXBIODB01246)	0.559(CHEMBL4525742) 0.468(DBMET01392) 0.459(METXBIODB01249 )
Rhinitis treatment	0.989(CHEMBL1473;­DB00588) 0.985(DB08906) 0.913(CHEMBL1512)	0.972(DBMET03675) 0.887(CHEMBL3542337) 0.881(CHEMBL3542213 )
Insulin like growth factor 3 antagonist	0.033(METXBIODB02739) 0.015(METXBIODB01176;­METXBIODB02805) 0.011(METXBIODB03045)	0.014(METXBIODB03149) 0.013(CHEMBL1432;­METXBIODB02740) 0.012(CHEMBL3544545;­DBMET01195;­METXBIODB00605 )
Liver cirrhosis treatment	0.680(METXBIODB02451) 0.656(CHEMBL1393;­DB00421) 0.646(DB00564)	0.693(CHEMBL3526499;­CHEMBL4525805;­DBMET02803;­DBMET02804) 0.680(DBMET00862) 0.659(CHEMBL313120;­CHEMBL315985;­DBMET01020;­DBMET01408;­DBMET01410;­DBMET02148;­DBMET02802 )
Growth factor agonist	0.716(DB00396;­METXBIODB01192) 0.715(DB11596) 0.693(DB08881)	0.790(DB00166) 0.733(CHEMBL50995;­DBMET02716) 0.676(DBMET02715 )
Antineoplastic (lymphoma)	0.916(CHEMBL88;­DB00531;­METXBIODB00960) 0.888(METXBIODB01643) 0.866(DB06697)	0.916(DBMET01683) 0.866(CHEMBL913;­DBMET01125) 0.850(CHEMBL3706538 )
S-adenosyl-L-homocysteine hydrolase inhibitor	0.423(DB00640) 0.233(DB01914;­DB09419;­DB11735) 0.228(DB00242)	0.325(METXBIODB02147) 0.308(CHEMBL3544842) 0.295(METXBIODB02698 )
Bradykinin B2 receptor antagonist	0.120(DB00500) 0.057(DB13306) 0.052(DB01131)	0.997(METXBIODB00275) 0.072(DBMET02067) 0.063(CHEMBL3544779 )
Topoisomerase II alpha inhibitor	0.967(CHEMBL417;­CHEMBL53463;­DB00997) 0.952(CHEMBL1117) 0.932(CHEMBL178;­DB00694)	0.929(DBMET00952;­METXBIODB01758;­METXBIODB01760) 0.925(METXBIODB01759) 0.923(CHEMBL3508153;­DBMET01078 )
HIV-1 reverse transcriptase inhibitor	0.961(CHEMBL223228;­DB00625) 0.921(METXBIODB00319) 0.909(METXBIODB02947)	0.961(CHEMBL4525162) 0.933(CHEMBL1309;­DBMET01653) 0.930(CHEMBL3526537 )
Allergic rhinitis treatment	0.993(CHEMBL1473;­DB00588) 0.991(DB08906) 0.943(CHEMBL1512)	0.988(DBMET03675) 0.938(CHEMBL3542373;­DBMET02914) 0.931(CHEMBL3542395;­DBMET00476;­METXBIODB01746 )
Mcl-1 antagonist	0.789(DB11121) 0.702(METXBIODB02353) 0.600(METXBIODB01861)	0.680(CHEMBL3544545) 0.660(CHEMBL1432) 0.586(METXBIODB00184;­METXBIODB00185 )
Antineoplastic (bladder cancer)	0.903(DB04168) 0.889(DB06263) 0.753(CHEMBL185)	0.984(CHEMBL525;­DBMET01147) 0.972(CHEMBL3706540;­DBMET01123) 0.971(CHEMBL1593;­DBMET00658 )
Integrin alphaLbeta2 antagonist	0.522(CHEMBL503;­DB00227;­METXBIODB01008) 0.408(CHEMBL2104993;­DB09068) 0.360(CHEMBL1064;­DB00641;­METXBIODB01371)	0.731(METXBIODB02350) 0.403(CHEMBL3544685) 0.377(CHEMBL1201373 )
DNA gyrase inhibitor	0.513(DB01044) 0.481(DB00685;­METXBIODB02642) 0.477(DB01137)	0.487(DBMET03009) 0.409(METXBIODB01321) 0.367(DBMET03008 )
CXC chemokine receptor antagonist	0.536(DB06652) 0.345(CHEMBL104) 0.320(DB15071)	0.652(DBMET00081) 0.631(DBMET00080) 0.576(DBMET00083 )
Antineoplastic (lung cancer)	0.963(METXBIODB00685) 0.945(DB00361) 0.940(DB11641)	0.970(CHEMBL87658;­DBMET00020;­DBMET00021;­METXBIODB00961;­METXBIODB00964) 0.962(METXBIODB00687) 0.952(METXBIODB00686;­METXBIODB00688 )
CDK3/cyclin E inhibitor	0.220(CHEMBL1308;­DB01213) 0.214(DB06595) 0.209(DB00740)	0.220(METXBIODB01632) 0.219(DBMET02815) 0.204(CHEMBL3276272;­DBMET00736 )
Potassium channel Kv1.5 blocker	0.303(DB15071) 0.284(CHEMBL1393;­DB00421) 0.169(METXBIODB00189)	0.330(DBMET03559) 0.224(CHEMBL804;­DBMET00977) 0.223(DBMET00451 )
CC chemokine 6 receptor antagonist	0.203(METXBIODB02395) 0.194(METXBIODB03128) 0.191(DB13751)	0.198(CHEMBL3542275) 0.189(METXBIODB03129) 0.186(METXBIODB02872 )
Protein kinase (CK1) gamma 3 inhibitor	0.520(DB06595) 0.500(DB06637) 0.405(METXBIODB00935)	0.820(DBMET03336) 0.762(DBMET03335) 0.519(DB13526 )
Tyk2 inhibitor	0.681(DB11697) 0.616(DB16650) 0.520(DB06799)	0.710(DBMET03436) 0.669(DBMET03437) 0.665(DBMET03435;­DBMET03438 )
MAP kinase 8 inhibitor	0.498(METXBIODB02480) 0.459(DB00507) 0.294(METXBIODB02343)	0.821(CHEMBL3544805) 0.577(DBMET01012) 0.368(DBMET03719 )
Polo-like kinase-3 inhibitor	0.343(DB00339) 0.327(DB00619) 0.313(DB00889;­DB11763;­METXBIODB00874)	0.568(DBMET00960) 0.465(DBMET00836) 0.433(DBMET03336 )
Dual specificity tyrosine-phosphorylation regulated kinase 3 inhibitor	0.537(DB00379;­DB07129;­METXBIODB01843) 0.451(DB06637) 0.446(METXBIODB00935)	0.945(DBMET02617) 0.673(DBMET03336) 0.590(DBMET03335 )
Interleukin-1 receptor-associated protein kinase 1 inhibitor	0.487(DB11697) 0.464(DB08865) 0.440(METXBIODB00935)	0.788(DBMET03336) 0.691(DBMET03335) 0.636(DBMET03436 )
Cyclin-dependent kinase 5 inhibitor	0.514(METXBIODB00382) 0.511(METXBIODB02059) 0.415(CHEMBL64;­METXBIODB02327)	0.751(CHEMBL3091852) 0.566(CHEMBL1442231) 0.506(METXBIODB01084 )
DNA-dependent protein kinase inhibitor	0.483(METXBIODB01339) 0.269(METXBIODB02723) 0.254(METXBIODB02149)	0.314(DBMET02020) 0.270(DBMET02028) 0.260(DBMET02027 )
CDK1/cyclin B1 inhibitor	0.422(DB09073) 0.402(DB02377) 0.278(CHEMBL727)	0.751(DBMET03666) 0.451(DBMET00493) 0.388(CHEMBL226396 )
CDK1/cyclin B inhibitor	0.548(DB02377) 0.350(CHEMBL585;­DB00384) 0.332(DB09073)	0.724(DBMET03666) 0.517(DBMET00493) 0.494(CHEMBL1231106 )
Antiischemic	0.994(DB06154;­DB09282) 0.991(DB00727) 0.984(DB01020)	0.995(DB13400) 0.991(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.967(DBMET02011 )
Antineoplastic (glioblastoma multiforme)	0.846(METXBIODB02420) 0.817(DB06176;­DB11638) 0.807(DB06697)	0.850(CHEMBL3526352) 0.817(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.808(METXBIODB00455 )
Alpha 1L adrenoreceptor agonist	0.436(CHEMBL762;­DB00935) 0.357(DB04948) 0.267(METXBIODB02632)	0.436(CHEMBL4525123;­CHEMBL4525124) 0.354(CHEMBL3526775) 0.239(DBMET03228 )
Fibroblast growth factor 4 antagonist	0.945(DB12147) 0.348(METXBIODB02632) 0.300(METXBIODB01643)	0.861(DBMET03649) 0.526(DBMET03650) 0.273(METXBIODB02633 )
HERG channel blocker	0.941(DB08903) 0.857(DB01074;­METXBIODB00067) 0.794(METXBIODB00769)	0.940(CHEMBL3527233) 0.934(DBMET03738) 0.907(CHEMBL3527437 )
CXC chemokine 3 receptor antagonist	0.341(DB01744;­DB11345;­METXBIODB01913) 0.202(DB11219) 0.166(METXBIODB00070)	0.151(DBMET02092) 0.137(DBMET02091) 0.135(DBMET02865 )
Bromodomain-containing protein 4 inhibitor	0.367(DB00580) 0.319(CHEMBL661;­DB00404) 0.318(DB09166;­METXBIODB00801)	0.350(CHEMBL3542314;­DBMET02634) 0.336(DBMET02821) 0.334(DBMET01338 )
Antifibrinolytic	0.916(METXBIODB01752) 0.864(DB15456) 0.838(CHEMBL1201772;­DB06209)	0.916(CHEMBL3526430) 0.864(DBMET03244;­DBMET03245) 0.850(CHEMBL3542415 )
Antineoplastic (liver cancer)	0.916(DB00526) 0.911(DB13853) 0.812(METXBIODB02583)	0.914(DBMET02057) 0.832(METXBIODB01867) 0.825(METXBIODB01898 )
Cyclin-dependent kinase 7 inhibitor	0.401(METXBIODB02968) 0.392(DB12267) 0.312(DB00619)	0.773(CHEMBL3526813) 0.524(CHEMBL3526899) 0.496(CHEMBL226396 )
CDK2/cyclin E inhibitor	0.196(CHEMBL585;­DB00384) 0.184(DB09073) 0.122(DB00740)	0.257(METXBIODB00380) 0.204(DBMET02372) 0.191(DBMET02371 )
Platelet activating factor alpha antagonist	0.694(DB09079) 0.520(CHEMBL535) 0.494(METXBIODB02699)	0.687(DBMET02777) 0.627(DBMET02778) 0.562(DBMET01384 )
Bradykinin B1 receptor antagonist	0.112(DB01104) 0.111(METXBIODB02132) 0.075(DB01394)	0.187(METXBIODB01325) 0.125(CHEMBL3526370) 0.067(CHEMBL3526187 )
Phenylethanolamine N methyltransferase inhibitor	0.180(METXBIODB02132) 0.128(METXBIODB01155) 0.118(DB01074;­METXBIODB00067)	0.208(CHEMBL3527402) 0.107(CHEMBL219497;­DBMET00655;­DBMET02004;­DBMET03581) 0.103(CHEMBL80254 )
Vasculitis treatment	0.969(CHEMBL88;­DB00531;­METXBIODB00960) 0.776(DB12902;­METXBIODB00967) 0.656(DB00993)	0.969(DBMET01683) 0.897(CHEMBL3544546;­DBMET01076) 0.888(CHEMBL3706538 )
Mood disorders treatment	0.973(DB09291) 0.972(DB01221;­DB11823;­METXBIODB00118) 0.970(METXBIODB02903)	0.992(DBMET02412) 0.988(DBMET00189;­METXBIODB00119) 0.986(DBMET01310 )
Protein kinase C delta inhibitor	0.993(DB09348) 0.921(DB06595) 0.416(DB01685;­METXBIODB02526)	0.937(DBMET01440) 0.852(DBMET01441) 0.291(CHEMBL3544877;­DBMET02829 )
Multiple sclerosis treatment	0.987(DB01236) 0.881(DB08911) 0.767(DB01017)	0.903(DBMET01507) 0.887(DBMET03641) 0.861(DBMET01474 )
Sodium/hydrogen exchanger 1 inhibitor	0.251(METXBIODB00562) 0.183(DB00629) 0.154(CHEMBL355862)	0.137(METXBIODB00563) 0.136(CHEMBL3526475) 0.131(METXBIODB00564 )
Antineoplastic (gastric cancer)	0.992(DB00526) 0.874(DB13853) 0.776(DB00727)	0.994(DBMET03683) 0.877(CHEMBL3544522) 0.858(DBMET02057 )
Death-associated protein kinase 3 inhibitor	0.690(DB08877) 0.579(DB06595) 0.495(DB00379;­DB07129;­METXBIODB01843)	0.740(DBMET03336) 0.726(CHEMBL226396) 0.667(DBMET03335 )
Antidepressant	0.973(DB01221;­DB11823;­METXBIODB00118) 0.972(METXBIODB02903) 0.971(DB09291)	0.993(DBMET02412) 0.988(DBMET00189;­METXBIODB00119) 0.986(DBMET01310 )
MAP3K7 inhibitor	0.546(DB01189) 0.412(METXBIODB00350) 0.311(DB08865)	0.442(CHEMBL1213529;­DBMET01146) 0.431(DBMET01440) 0.326(METXBIODB01644 )
Glycogen synthase kinase-3 beta inhibitor	0.892(CHEMBL727) 0.512(DB01685;­METXBIODB02526) 0.338(DB02377)	0.836(CHEMBL1426) 0.472(DBMET02815) 0.452(DBMET00414 )
Antiviral (HIV)	0.991(DB00709) 0.986(DB00879) 0.954(DB00495)	0.985(DBMET00899) 0.983(DBMET00898) 0.942(DBMET03569 )
Glycogen synthase kinase-3 inhibitor	0.908(CHEMBL727) 0.552(DB01685;­METXBIODB02526) 0.439(CHEMBL1308;­DB01213)	0.845(CHEMBL1426) 0.514(DBMET02815) 0.486(DBMET01583;­METXBIODB00386 )
Antineoplastic (small cell lung cancer)	0.967(DB06263) 0.958(DB09117) 0.954(DB00444;­DB00773;­METXBIODB00808)	0.998(DBMET01127) 0.982(DBMET01102) 0.978(DBMET00792 )
Vanilloid 1 antagonist	0.671(DB12015) 0.434(METXBIODB03128) 0.334(CHEMBL1076347)	0.661(DBMET02571) 0.401(DBMET00693) 0.260(DBMET00909 )
Potassium channel blocker	0.856(DB08903) 0.710(DB00213;­METXBIODB00543) 0.707(DB01074;­METXBIODB00067)	0.853(CHEMBL3527233) 0.828(DBMET03738) 0.784(METXBIODB00566 )
Beta tubulin antagonist	0.701(METXBIODB00509) 0.670(METXBIODB02619) 0.668(DB01394)	0.712(DBMET00398;­DBMET00401) 0.705(DBMET02757;­METXBIODB00510;­METXBIODB00512) 0.681(DBMET02756;­METXBIODB00511 )
MAP kinase 7 inhibitor	0.156(DB09079) 0.153(DB06595) 0.121(METXBIODB00039)	0.142(DBMET02777) 0.140(DBMET01384) 0.139(DBMET02778 )
Hedgehog signaling inhibitor	0.951(CHEMBL64391;­DB01167;­METXBIODB00524) 0.773(DB01026) 0.627(DB08828)	0.952(DBMET00374;­METXBIODB00525) 0.951(CHEMBL4525087;­CHEMBL4525088) 0.929(METXBIODB00526 )
Purinergic P2X2 antagonist	0.322(METXBIODB01202) 0.321(DB00451;­DB00509;­METXBIODB02811) 0.317(DB00279;­METXBIODB02434)	0.377(METXBIODB02350;­METXBIODB02355) 0.336(DBMET02275) 0.330(DB00171 )
Protein kinase C theta inhibitor	0.472(DB06595) 0.341(METXBIODB00917) 0.339(DB01685;­METXBIODB02526)	0.497(DBMET01440) 0.480(CHEMBL3544902;­DBMET02826) 0.391(DBMET01441 )
5 Lipoxygenase activating protein inhibitor	0.046(METXBIODB02380) 0.044(DB05016) 0.018(DB11932)	0.166(CHEMBL1231106) 0.026(CHEMBL3544874) 0.022(CHEMBL3544897;­CHEMBL3544898 )
ATM kinase inhibitor	0.254(METXBIODB01884) 0.182(METXBIODB00310) 0.160(METXBIODB01593)	0.296(DBMET00513) 0.200(METXBIODB01144) 0.195(METXBIODB00311 )
Ca2+/calmodulin-dependent kinase II delta inhibitor	0.653(METXBIODB01288) 0.611(DB06595) 0.546(DB06824)	0.804(DBMET01440) 0.630(METXBIODB01289) 0.585(DBMET03336 )
Protein kinase B gamma inhibitor	0.458(DB13931) 0.396(DB06824) 0.268(DB00181)	0.688(CHEMBL244377) 0.651(DBMET02043) 0.598(CHEMBL3544897;­CHEMBL3544898 )
Protein kinase C mu inhibitor	0.953(DB06595) 0.417(DB00592) 0.374(METXBIODB00935)	0.967(DBMET01440) 0.861(DBMET01441) 0.502(DBMET02759 )
Cyclin-dependent kinase 4 inhibitor	0.915(DB09073) 0.326(DB00592) 0.217(DB12010)	0.876(DBMET02365) 0.873(DBMET02373) 0.850(DBMET02380 )
MAP kinase kinase 6 inhibitor	0.919(DB06595) 0.754(METXBIODB01288) 0.746(CHEMBL817)	0.893(DBMET01440) 0.891(DBMET01441) 0.754(METXBIODB01813 )
Protein kinase (CK1) gamma 1 inhibitor	0.484(CHEMBL1076347) 0.478(DB06595) 0.475(DB06637)	0.716(DBMET03336) 0.694(CHEMBL1231106) 0.646(DBMET03335 )
Huntington's disease treatment	0.900(CHEMBL104) 0.784(DB04844) 0.746(DB11915)	0.989(CHEMBL3526601) 0.817(DB12243) 0.761(DBMET00458;­DBMET00800;­DBMET01448 )
Potassium channel (Voltage-sensitive) blocker	0.920(DB08903) 0.826(DB01074;­METXBIODB00067) 0.821(CHEMBL104)	0.920(CHEMBL3527233) 0.912(DBMET03738) 0.883(CHEMBL3527437 )
Alpha 1a adrenoreceptor agonist	0.463(CHEMBL762;­DB00935) 0.450(METXBIODB02632) 0.430(DB04948)	0.463(CHEMBL4525123;­CHEMBL4525124) 0.330(CHEMBL3526775) 0.295(METXBIODB02633 )
Protein kinase C nu inhibitor	0.974(DB06595) 0.615(DB08877) 0.477(METXBIODB00935)	0.981(DBMET01440) 0.924(DBMET01441) 0.550(CHEMBL226396 )
Urologic disorders treatment	0.981(METXBIODB00334) 0.956(DB01062;­METXBIODB00150) 0.945(DB00280)	0.986(DBMET01568;­DBMET03354;­METXBIODB00151) 0.975(METXBIODB00335) 0.972(METXBIODB00336 )
Proto-oncogene tyrosine-protein kinase Yes inhibitor	0.701(DB01254) 0.695(CHEMBL741;­DB00555) 0.554(METXBIODB02879)	0.717(DBMET03622) 0.685(DBMET03625) 0.681(DBMET03437 )
Tyrosine-protein kinase EMT inhibitor	0.576(DB09053) 0.567(CHEMBL1308;­DB01213) 0.431(METXBIODB01643)	0.475(CHEMBL244377) 0.382(DBMET02094) 0.380(CHEMBL1231106 )
Janus tyrosine kinase 3 inhibitor	0.909(DB08877) 0.836(DB11697) 0.694(DB14973)	0.880(DBMET03436) 0.848(DBMET03261) 0.802(DBMET03263 )
Urinary incontinence treatment	0.981(METXBIODB00334) 0.951(DB01062;­METXBIODB00150) 0.935(DB00280)	0.985(DBMET01568;­DBMET03354;­METXBIODB00151) 0.973(METXBIODB00335) 0.968(METXBIODB00336 )
Antineoplastic (non-small cell lung cancer)	0.928(DB01181;­METXBIODB00963) 0.915(METXBIODB02544) 0.865(DB06263)	0.954(CHEMBL3706540;­DBMET01123) 0.940(CHEMBL525;­DBMET01147) 0.938(CHEMBL1593;­DBMET00658 )
Phosphodiesterase 7A inhibitor	0.175(CHEMBL16;­DB00252) 0.120(DB00972;­METXBIODB00107;­METXBIODB01852) 0.079(METXBIODB00635)	0.429(CHEMBL3706470) 0.179(DBMET03340) 0.175(DBMET01170 )
Histone deacetylase stimulant	0.838(DB13853) 0.639(CHEMBL1783834) 0.458(METXBIODB00715)	0.854(DBMET02057) 0.669(CHEMBL3542280;­CHEMBL4525725) 0.563(CHEMBL3542285;­CHEMBL4525726 )
Histone deacetylase SIRT1 stimulant	0.838(DB13853) 0.639(CHEMBL1783834) 0.458(METXBIODB00715)	0.854(DBMET02057) 0.669(CHEMBL3542280;­CHEMBL4525725) 0.563(CHEMBL3542285;­CHEMBL4525726 )
Cardiotonic	0.963(DB00727) 0.958(DB00373;­METXBIODB01469) 0.948(DB00922)	0.963(DBMET02594;­DBMET02595;­DBMET02596;­DBMET02597;­DBMET02598) 0.937(DBMET02502;­METXBIODB00731) 0.921(DBMET00973 )
Antineoplastic (glioma)	0.848(DB11638) 0.843(DB06697) 0.838(METXBIODB02420)	0.848(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.843(CHEMBL3526352) 0.842(METXBIODB00455 )
Cyclin-dependent kinase 2 inhibitor	0.747(DB09073) 0.694(DB11697) 0.434(DB01438)	0.858(DBMET03436) 0.712(DBMET02378) 0.705(DBMET02373 )
Platelet growth factor antagonist	0.864(METXBIODB02699) 0.841(DB12072) 0.840(CHEMBL535)	0.883(CHEMBL3542196) 0.839(CHEMBL3542344) 0.829(CHEMBL3542399 )
Urokinase inhibitor	0.281(METXBIODB00562) 0.219(CHEMBL169901;­DB04840) 0.210(METXBIODB01173)	0.435(DBMET03118) 0.273(DBMET01778) 0.269(METXBIODB01825 )
Nootropic	0.980(DB00185;­METXBIODB00507) 0.859(DB13345) 0.801(METXBIODB00369)	0.980(DBMET00430;­DBMET00431;­DBMET00433) 0.928(METXBIODB00508) 0.848(CHEMBL3526811 )
MAP kinase 9 inhibitor	0.464(DB01685;­METXBIODB02526) 0.424(METXBIODB02343) 0.396(METXBIODB00513)	0.815(CHEMBL3544805) 0.449(DBMET03719) 0.426(METXBIODB00515 )
Janus tyrosine kinase 2 inhibitor	0.784(DB11697) 0.773(DB08877) 0.617(DB14973)	0.802(DBMET03436) 0.768(DBMET03438) 0.767(DBMET03437 )
LIM domain kinase 2 inhibitor	0.253(METXBIODB00244) 0.129(METXBIODB00565) 0.095(CHEMBL2103817)	0.246(CHEMBL3526890) 0.128(CHEMBL3526891) 0.081(CHEMBL3527277 )
Bradykinin antagonist	0.163(METXBIODB02132) 0.130(DB00228;­METXBIODB00116) 0.128(DB00500)	0.998(METXBIODB00275) 0.168(CHEMBL3544779) 0.138(DBMET02067 )
Protein kinase (CK1) delta inhibitor	0.478(CHEMBL585;­DB00384) 0.378(DB00740) 0.325(METXBIODB00935)	0.579(CHEMBL1231106) 0.491(CHEMBL3544897;­CHEMBL3544898) 0.452(CHEMBL244377 )
Nav1.8 sodium channel blocker	0.431(METXBIODB02615) 0.405(DB12466) 0.343(METXBIODB00039)	0.455(DBMET03065) 0.384(DBMET00415) 0.336(METXBIODB02617 )
Purinergic P2Y2 antagonist	0.151(DB01320) 0.123(METXBIODB02999) 0.122(DB06716)	0.310(CHEMBL1426) 0.230(CHEMBL1774;­DBMET02000;­DBMET03590) 0.223(CHEMBL3638285 )
CDK4/cyclin D inhibitor	0.865(DB09073) 0.198(DB00592) 0.157(METXBIODB02611)	0.843(DBMET02373) 0.826(DBMET02380) 0.818(DBMET02365 )
Inflammatory Bowel disease treatment	0.903(DB01236) 0.858(DB16650) 0.802(CHEMBL104)	0.994(METXBIODB00716) 0.966(DBMET01398) 0.848(DBMET03547 )
Protein kinase C iota inhibitor	0.632(DB06595) 0.255(DB06824) 0.222(DB06153)	0.668(DBMET01440) 0.525(DBMET01441) 0.274(CHEMBL3526308 )
Abl kinase inhibitor	0.678(METXBIODB01339) 0.611(DB00437) 0.466(METXBIODB00935)	0.543(DBMET03622) 0.522(DBMET02020) 0.493(CHEMBL3544806 )
Protein-tyrosine kinase (PTK, not ETK, WZC) inhibitor	0.679(METXBIODB01339) 0.612(DB00437) 0.466(METXBIODB00935)	0.543(DBMET03622) 0.523(DBMET02020) 0.493(CHEMBL3544806 )
MAP kinase 13 inhibitor	0.820(METXBIODB00513) 0.432(DB13228) 0.361(METXBIODB00935)	0.811(METXBIODB00515) 0.605(METXBIODB00514) 0.448(DBMET01440 )
Protein kinase (CK1) gamma 2 inhibitor	0.349(CHEMBL1076347) 0.342(METXBIODB00935) 0.336(DB00697;­METXBIODB02082)	0.676(DBMET03336) 0.657(CHEMBL1231106) 0.558(DBMET03335 )
Protein kinase (CK1) gamma inhibitor	0.453(DB06637) 0.426(CHEMBL1076347) 0.415(METXBIODB00935)	0.660(DBMET03336) 0.652(CHEMBL1231106) 0.558(DBMET03335 )
Heart failure treatment	0.966(DB00922) 0.936(DB00727) 0.895(DB15456)	0.977(CHEMBL3526601) 0.963(DBMET01338) 0.955(DBMET01342 )
Fibroblast growth factor 1 antagonist	0.961(DB12147) 0.690(METXBIODB02632) 0.613(DB09079)	0.918(DBMET03649) 0.774(DBMET03650) 0.670(CHEMBL3527569 )
Tyrosine kinase inhibitor	0.958(DB08877) 0.940(DB08865) 0.930(DB11697)	0.942(DBMET03261;­DBMET03436) 0.921(DBMET03537) 0.917(DBMET03437 )
Check point kinase 2 inhibitor	0.627(METXBIODB00880) 0.429(DB00730) 0.397(CHEMBL1140)	0.530(CHEMBL2030560) 0.519(DBMET00376) 0.495(CHEMBL3527286 )
Cyclin-dependent kinase 1 inhibitor	0.663(DB09073) 0.657(DB01438) 0.633(DB02377)	0.884(DBMET02996) 0.712(DBMET02378) 0.587(DBMET02380 )
Prokineticin receptor 1 antagonist	0.033(DB01131;­METXBIODB00330) 0.032(METXBIODB01173) 0.021(DB01189;­METXBIODB01455;­METXBIODB02090)	0.038(DBMET01778) 0.026(DBMET03020;­METXBIODB01174) 0.025(METXBIODB00331 )
Adenosine A2b receptor agonist	0.654(DB00640) 0.617(DB00242) 0.536(DB00631)	0.372(CHEMBL3526900) 0.302(DBMET01159) 0.283(DBMET00485;­DBMET03265 )
Raf kinase B inhibitor	0.891(DB08881) 0.819(DB08912) 0.731(CHEMBL685;­DB00643)	0.758(DBMET03512) 0.698(DBMET03510) 0.676(DBMET01854 )
Ca2+/calmodulin-dependent kinase II gamma inhibitor	0.859(DB06595) 0.831(METXBIODB01288) 0.608(DB00379;­DB07129;­METXBIODB01843)	0.946(DBMET01440) 0.818(DBMET01441) 0.816(DBMET02759 )
Proto-oncogene tyrosine-protein kinase Fyn inhibitor	0.841(DB00190) 0.835(DB01074;­METXBIODB00067) 0.544(DB08877)	0.677(DBMET00839;­DBMET00914;­DBMET01547;­METXBIODB00068;­METXBIODB00069) 0.574(CHEMBL3544806) 0.559(CHEMBL1231106 )
Stem cell growth factor agonist	0.647(DB08881) 0.432(DB00585) 0.391(DB00863;­METXBIODB01235)	0.523(DBMET01856) 0.511(DBMET01854) 0.429(DBMET00959 )
Proto-oncogene tyrosine-protein kinase Kit inhibitor	0.546(CHEMBL535) 0.493(DB00398) 0.374(DB00619)	0.527(CHEMBL3542344) 0.508(CHEMBL3542333) 0.492(CHEMBL3542399 )
Protein kinase A inhibitor	0.991(DB06595) 0.484(DB13931) 0.396(DB06824)	0.994(DBMET01440) 0.970(DBMET01441) 0.588(DBMET02043 )
Check point kinase 1 inhibitor	0.655(DB01685;­METXBIODB02526) 0.401(DB06595) 0.371(DB00592)	0.768(DBMET02815) 0.534(DBMET00414) 0.492(DBMET00513 )
Ca2+/calmodulin-dependent protein kinase inhibitor	0.883(DB06595) 0.753(METXBIODB01288) 0.668(DB06824)	0.937(DBMET01440) 0.829(DBMET01441) 0.824(DBMET00920 )
Liver fibrosis treatment	0.804(DB06755) 0.783(CHEMBL64391;­DB01167;­METXBIODB00524) 0.768(DB00755;­DB00982;­METXBIODB00937)	0.783(CHEMBL4525087;­CHEMBL4525088) 0.768(DB00523;­DBMET02046;­DBMET02548;­METXBIODB00324;­METXBIODB01253) 0.747(METXBIODB00526 )
Ca2+/calmodulin-dependent kinase I alpha inhibitor	0.813(METXBIODB01288) 0.794(DB06595) 0.578(METXBIODB00880)	0.769(METXBIODB01289) 0.719(DBMET01441) 0.687(DBMET01440 )
Phosphatidylinositol 3-kinase delta inhibitor	0.956(DB09054) 0.412(METXBIODB01339) 0.366(CHEMBL727)	0.789(DBMET01387) 0.665(CHEMBL1178) 0.538(CHEMBL1172777 )
Topoisomerase II inhibitor	0.973(CHEMBL1117) 0.971(DB00773;­METXBIODB00808) 0.970(CHEMBL417;­CHEMBL53463;­DB00997;­DB09117)	0.970(DBMET00367;­DBMET01264;­METXBIODB00809) 0.968(DBMET01265) 0.953(CHEMBL3508145 )
Antiparkinsonian	0.979(DB11632) 0.978(DB00190) 0.974(DB13345)	0.974(DBMET03238) 0.973(DBMET03236) 0.971(DBMET03237 )
Phosphodiesterase VII inhibitor	0.559(DB00862) 0.272(CHEMBL16;­DB00252) 0.159(DB00972;­METXBIODB00107;­METXBIODB01852)	0.560(DBMET03640) 0.544(CHEMBL3706470) 0.272(DBMET01170 )
Protein kinase B beta inhibitor	0.358(DB01685;­METXBIODB02526) 0.350(DB01043) 0.201(DB00437)	0.448(DBMET00189;­METXBIODB00119) 0.411(CHEMBL3526890) 0.361(DBMET01310 )
Antineoplastic (squamous cell carcinoma)	0.856(METXBIODB00685) 0.810(DB06697) 0.806(DB00773;­METXBIODB00808)	0.855(METXBIODB00687) 0.844(METXBIODB00688) 0.842(METXBIODB00686 )
Protein kinase (CK1) inhibitor	0.544(DB00339) 0.461(CHEMBL585;­DB00384) 0.424(DB08877)	0.591(CHEMBL1231106) 0.512(DBMET03065) 0.490(CHEMBL3544897;­CHEMBL3544898 )
Tyrosine-protein kinase receptor FLT3 inhibitor	0.978(DB11697) 0.891(DB12874) 0.843(DB12147)	0.986(DBMET03436) 0.962(DBMET03437) 0.960(DBMET03435 )
Antieczematic atopic	0.826(CHEMBL1473;­DB00588) 0.804(DB00764) 0.802(DB06756)	0.895(DB03947) 0.819(DBMET00997) 0.804(DBMET02361 )
ALK inhibitor	0.979(DB12267) 0.731(DB11363) 0.481(DB08865)	0.719(DBMET02145) 0.597(DBMET01404) 0.542(DBMET02147 )
CDC-like kinase 1 inhibitor	0.861(METXBIODB00382) 0.806(METXBIODB02059) 0.493(METXBIODB01431)	0.724(METXBIODB02060) 0.713(DBMET01868) 0.689(METXBIODB00384 )
CDC-like kinase 4 inhibitor	0.701(METXBIODB00858) 0.613(DB08877) 0.560(METXBIODB00385)	0.634(CHEMBL226396) 0.502(CHEMBL3526631) 0.501(METXBIODB00387 )
TRKB antagonist	0.465(DB08877) 0.370(DB15305) 0.368(METXBIODB02929)	0.374(DBMET03262) 0.355(CHEMBL3544806) 0.347(DBMET03263 )
Sodium/calcium exchanger inhibitor	0.289(METXBIODB02735) 0.224(DB01429) 0.212(DB06728)	0.246(METXBIODB00274) 0.212(DBMET02709;­METXBIODB00395) 0.199(DBMET03561 )
CDK4/cyclin D1 inhibitor	0.886(DB09073) 0.239(DB00592) 0.236(METXBIODB02611)	0.856(DBMET02373) 0.839(DBMET02365) 0.822(DBMET02380 )
Protein kinase (CaMK, MLCK, PhK, SNF, KIN, NIM1, MAPKAP, POLO, CHK, ULK, RSK-2nd domain) inhibitor	0.725(DB01685;­METXBIODB02526) 0.469(DB06595) 0.441(DB00592)	0.791(DBMET02815) 0.583(DBMET01440) 0.569(DBMET00414 )
TIE-2 antagonist	0.418(CHEMBL685;­DB00643) 0.390(DB00398) 0.380(CHEMBL1076347)	0.971(CHEMBL244377) 0.942(CHEMBL3544897;­CHEMBL3544898) 0.863(CHEMBL3544872;­CHEMBL457723 )
Bruton tyrosine kinase inhibitor	0.958(DB11703) 0.946(DB09053) 0.905(METXBIODB01643)	0.918(DBMET02888) 0.909(DBMET02890) 0.847(DBMET02027 )
CDC-like kinase 2 inhibitor	0.714(DB08877) 0.493(METXBIODB00935) 0.421(DB06637)	0.733(CHEMBL226396) 0.593(DBMET03336) 0.503(DBMET03263 )
Macular degeneration treatment	0.943(DB00869) 0.905(DB01236) 0.846(DB01194)	0.955(DBMET03010) 0.825(DBMET03671) 0.728(DBMET01736 )
TRKC antagonist	0.644(DB08877) 0.551(DB00437) 0.518(CHEMBL535)	0.570(DBMET03262) 0.559(DBMET03263) 0.543(CHEMBL3542333 )
TIE antagonist	0.434(DB00398) 0.431(CHEMBL685;­DB00643) 0.397(CHEMBL1076347)	0.972(CHEMBL244377) 0.942(CHEMBL3544897;­CHEMBL3544898) 0.864(CHEMBL3544872;­CHEMBL457723 )
Dual specificity tyrosine-phosphorylation regulated kinase 1B inhibitor	0.790(METXBIODB00209) 0.676(DB08877) 0.463(METXBIODB00935)	0.896(DBMET00830) 0.685(METXBIODB00210) 0.671(METXBIODB00211 )
CDK/cyclin complex inhibitor	0.911(DB09073) 0.398(DB11697) 0.361(CHEMBL585;­DB00384)	0.899(DBMET02373) 0.889(DBMET02380) 0.867(DBMET02365 )
Protein kinase B alpha inhibitor	0.312(DB01685;­METXBIODB02526) 0.296(DB00437) 0.295(DB00379;­DB07129;­METXBIODB01843)	0.442(CHEMBL3526890) 0.369(DBMET00189;­METXBIODB00119) 0.253(CHEMBL3526891 )
Raf kinase inhibitor	0.908(DB08881) 0.829(DB08912) 0.774(CHEMBL685;­DB00643)	0.778(DBMET03512) 0.728(DBMET01854) 0.719(DBMET03510 )
Sodium/hydrogen exchanger inhibitor	0.356(METXBIODB00562) 0.352(DB11761) 0.277(CHEMBL355862)	0.214(CHEMBL3526475) 0.180(METXBIODB00563) 0.178(DBMET01778 )
Antineoplastic (osteosarcoma)	0.956(DB00400) 0.773(CHEMBL185) 0.742(DB09256)	0.920(DBMET00765) 0.773(DB00544;­DBMET00449) 0.740(METXBIODB00147 )
Ribosomal protein S6 kinase inhibitor	0.535(DB00437) 0.496(DB00629) 0.494(DB06595)	0.457(DBMET01441) 0.445(DBMET01500) 0.426(DBMET00499 )
Polo-like kinase-4 inhibitor	0.415(DB11697) 0.299(DB00261) 0.274(DB12072)	0.483(DBMET03436) 0.433(DBMET03438) 0.408(DBMET03435 )
Vascular endothelial growth factor 1 antagonist	0.493(DB09079) 0.424(DB05294) 0.399(CHEMBL535)	0.456(DBMET02777) 0.432(DBMET00935) 0.421(CHEMBL3542257 )
Raf kinase C inhibitor	0.747(CHEMBL685;­DB00643) 0.722(DB00518) 0.697(DB08881)	0.731(CHEMBL2059159) 0.720(DBMET00791) 0.632(DBMET01854 )
ErbB-3 antagonist	0.790(METXBIODB00715) 0.406(DB06154) 0.394(DB00530)	0.942(DBMET01434) 0.689(DB13526) 0.563(DBMET02769 )
DNA directed RNA polymerase inhibitor	0.886(DB00709) 0.856(DB12301) 0.852(CHEMBL223228;­DB00625;­DB08864)	0.924(DBMET00899) 0.890(DBMET00898) 0.852(CHEMBL4525162 )
Pim-1 kinase inhibitor	0.313(DB11640) 0.305(METXBIODB00935) 0.289(DB00592)	0.512(DBMET01855) 0.482(METXBIODB00380) 0.357(DBMET02824 )
ErbB-4 antagonist	0.909(DB11963) 0.781(METXBIODB01643) 0.507(DB00530)	0.867(DBMET02190) 0.424(DBMET01790) 0.371(METXBIODB00387 )
Ca2+/calmodulin-dependent protein kinase kinase B inhibitor	0.834(DB09079) 0.684(DB06595) 0.329(METXBIODB00724;­METXBIODB01778)	0.898(DBMET02778) 0.821(DBMET02777) 0.799(DBMET01384 )
Growth factor antagonist	0.941(DB12147) 0.933(METXBIODB01643) 0.905(DB12267)	0.920(DBMET03650) 0.890(DBMET03649) 0.880(CHEMBL380905 )
Antineoplastic (uterine cancer)	0.843(CHEMBL1117) 0.834(CHEMBL417;­CHEMBL53463;­DB00997) 0.820(CHEMBL178;­DB00694)	0.804(CHEMBL3544591) 0.800(CHEMBL3508153;­DBMET01078) 0.783(DBMET00952 )
Proto-oncogene tyrosine-protein kinase Met inhibitor	0.983(DB08865) 0.140(CHEMBL377300) 0.107(METXBIODB00935)	0.950(DBMET03537) 0.585(DBMET02823) 0.359(DBMET02821 )
Antibiotic Cephalosporin-like	0.930(DB01413) 0.790(DB00493) 0.511(DB06590)	0.473(DBMET00646) 0.190(DBMET00641) 0.034(DBMET00758 )
Protein kinase (Mos, Mil/Raf, MEKK, RIPK, TESK, LIMK, IRAK, ILK, Activin/TGF-beta) inhibitor	0.922(DB08881) 0.871(DB08912) 0.788(CHEMBL685;­DB00643)	0.820(DBMET03512) 0.769(DBMET03510) 0.766(DBMET01854 )
Chronic obstructive pulmonary disease treatment	0.985(CHEMBL1473;­DB00588) 0.981(DB08906) 0.942(CHEMBL1512)	0.978(CHEMBL3706466) 0.967(DBMET03675) 0.953(DBMET01568;­DBMET03354;­METXBIODB00151 )
Focal adhesion kinase 1 inhibitor	0.957(DB12267) 0.151(METXBIODB02395) 0.149(DB14845)	0.449(DBMET02125) 0.179(DBMET03213) 0.172(DBMET02094 )
Clk dual-specificity kinase inhibitor	0.822(METXBIODB00382) 0.766(METXBIODB02059) 0.585(DB08877)	0.810(DBMET01868) 0.763(DBMET01864) 0.755(DBMET01865 )
Antineoplastic (ovarian cancer)	0.997(DB00526) 0.979(CHEMBL92;­DB01248) 0.977(CHEMBL428647;­DB01229)	0.999(DBMET03683) 0.991(DBMET03682) 0.979(DBMET00633 )
Toll-Like receptor agonist	0.994(CHEMBL1473;­DB00588;­DB08906) 0.991(METXBIODB01531) 0.983(CHEMBL1504;­CHEMBL1512)	0.993(DBMET03675) 0.988(CHEMBL3542300) 0.987(CHEMBL3542318 )
Cyclin-dependent kinase inhibitor	0.904(DB09073) 0.431(DB11697) 0.411(CHEMBL1308;­DB01213)	0.883(DBMET02373) 0.873(DBMET02380) 0.872(DBMET02365 )
Protein-tyrosine kinase Lyn inhibitor	0.622(DB01254) 0.510(CHEMBL1455) 0.488(DB00437)	0.684(DBMET03622) 0.655(CHEMBL1231106) 0.594(DBMET03625 )
Adenosine A1 receptor agonist	0.834(DB00242) 0.805(DB00640) 0.766(DB00631)	0.650(DBMET00485;­DBMET03265) 0.612(DBMET00419) 0.582(DBMET01159 )
Rho-associated kinase inhibitor	0.685(CHEMBL1308;­DB01213) 0.586(DB13931) 0.509(METXBIODB00935)	0.740(DBMET02043) 0.713(DBMET02815) 0.618(METXBIODB01534 )
Equilibrative nucleoside transport protein inhibitor	0.489(DB00640) 0.484(METXBIODB02474) 0.374(DB01280)	0.966(DBMET01160) 0.739(CHEMBL1178) 0.624(DBMET01159 )
Rho-associated kinase II inhibitor	0.768(CHEMBL1308;­DB01213) 0.559(DB13931) 0.479(METXBIODB00935)	0.758(DBMET02815) 0.732(METXBIODB01534) 0.665(DBMET02043 )
Antibiotic Trimethoprim-like	0.831(DB00440) 0.082(METXBIODB00281) 0.066(CHEMBL585;­DB00384)	0.737(DBMET03021) 0.719(DBMET03026) 0.551(DBMET03019 )
Antiprotozoal (Plasmodium)	0.994(DB06697;­DB11638) 0.993(METXBIODB00454) 0.984(DB09274;­METXBIODB01712)	0.994(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.993(METXBIODB00455) 0.978(DBMET00827 )
EphA2 antagonist	0.569(DB09185) 0.487(DB06799) 0.382(DB05294)	0.484(DBMET03493) 0.428(DB09401) 0.389(DBMET00935 )
Toll-Like receptor 7 agonist	0.994(CHEMBL1473;­DB00588;­DB08906) 0.991(METXBIODB01531) 0.983(CHEMBL1512)	0.993(DBMET03675) 0.988(CHEMBL3542300) 0.986(CHEMBL3542318;­DBMET02403 )
CDK7/cyclin H inhibitor	0.133(DB08912) 0.120(DB00619) 0.119(DB11763)	0.223(CHEMBL244377) 0.178(DBMET03713) 0.141(DBMET03719 )
Tubulin antagonist	0.944(DB00570) 0.935(DB00361) 0.925(DB11641)	0.953(DBMET00398;­DBMET00401) 0.941(DBMET02055) 0.922(DBMET02029 )
RET inhibitor	0.609(DB00437) 0.591(DB00530) 0.583(DB08877)	0.756(CHEMBL3544806) 0.692(CHEMBL1231106) 0.663(CHEMBL244377 )
Antineoplastic (melanoma)	0.931(DB06697) 0.928(DB06176) 0.917(DB11638)	0.969(CHEMBL913;­DBMET01125) 0.917(DBMET00443;­DBMET00793;­METXBIODB00457;­METXBIODB01713) 0.907(METXBIODB00455 )
Aurora-A kinase inhibitor	0.720(METXBIODB01487) 0.604(CHEMBL1308;­DB01213) 0.316(METXBIODB02395)	0.728(METXBIODB01489) 0.611(METXBIODB01488) 0.568(DBMET02094 )
Dual specificity tyrosine-phosphorylation regulated kinase 1A inhibitor	0.867(METXBIODB00382) 0.846(METXBIODB02059) 0.730(METXBIODB00935)	0.788(CHEMBL1231106) 0.784(METXBIODB02060) 0.762(DBMET00830 )
Dyrk kinase inhibitor	0.865(METXBIODB00382) 0.839(METXBIODB02059) 0.735(METXBIODB00935)	0.839(DBMET02617) 0.783(CHEMBL1231106) 0.771(METXBIODB02060 )
Antineoplastic (colon cancer)	0.981(DB00570) 0.976(DB00361) 0.968(METXBIODB01414)	0.973(DBMET00398;­DBMET00401;­DBMET02029) 0.964(METXBIODB01416) 0.958(METXBIODB01415 )
Vascular endothelial growth factor 3 antagonist	0.659(DB05294) 0.650(DB09079) 0.520(CHEMBL535)	0.707(DBMET00935) 0.659(DBMET02777) 0.626(DBMET02778 )
ZAP-70 protein tyrosine kinase inhibitor	0.327(DB12267) 0.190(DB08864) 0.137(DB00214)	0.226(DBMET02094) 0.210(DBMET01868) 0.185(DBMET01864 )
Phosphatidylinositol 3-kinase gamma inhibitor	0.943(CHEMBL1258517) 0.535(DB12015) 0.277(DB09054)	0.800(CHEMBL3526762) 0.421(DBMET02571) 0.211(DBMET02020 )
Vascular endothelial growth factor antagonist	0.891(DB12147) 0.825(CHEMBL535) 0.722(CHEMBL377300)	0.832(CHEMBL3542344) 0.825(CHEMBL3542333;­DBMET03649) 0.819(CHEMBL380905 )
Macrophage colony-stimulating factor 1 receptor antagonist	0.504(DB08865) 0.340(DB00339) 0.327(DB01097;­METXBIODB01809)	0.436(DBMET03537) 0.426(CHEMBL3542326;­DBMET02633) 0.303(CHEMBL3526899 )
Aurora-C kinase inhibitor	0.297(METXBIODB03012) 0.289(DB12010) 0.284(CHEMBL535)	0.346(DBMET02099) 0.339(DBMET02094) 0.328(DBMET02095 )
Vascular endothelial growth factor 2 antagonist	0.890(DB12147) 0.778(CHEMBL535) 0.704(CHEMBL377300)	0.826(DBMET03649) 0.802(CHEMBL380905) 0.784(CHEMBL3542344 )
Antineoplastic (colorectal cancer)	0.981(DB00570) 0.976(DB00361) 0.968(METXBIODB01414)	0.973(DBMET00398;­DBMET00401;­DBMET02029) 0.965(METXBIODB01416) 0.959(METXBIODB01415 )
Platelet activating factor beta antagonist	0.816(DB09079) 0.802(CHEMBL535) 0.790(DB12072)	0.939(METXBIODB02385) 0.806(DBMET02777) 0.792(CHEMBL3542344 )
Phosphatidylinositol 3-kinase alpha inhibitor	0.958(CHEMBL1258517) 0.209(DB12015) 0.184(DB12483)	0.827(CHEMBL3526762) 0.305(CHEMBL1231106) 0.280(CHEMBL3544897;­CHEMBL3544898 )
Phosphatidylinositol kinase inhibitor	0.957(CHEMBL1258517) 0.686(DB09054) 0.407(DB12015)	0.835(CHEMBL3526762) 0.447(CHEMBL1231106) 0.403(DBMET01387 )
Antiviral (Hepatitis B)	0.960(DB09299) 0.955(DB00300) 0.926(METXBIODB01187)	0.947(DBMET03569) 0.916(DBMET00898) 0.910(DBMET00899 )
Antiasthmatic	0.994(CHEMBL1473;­DB00588;­DB08906) 0.991(METXBIODB01531) 0.983(CHEMBL1512)	0.993(DBMET03675) 0.989(CHEMBL3542300) 0.986(CHEMBL3542318;­DBMET02403 )
Antineoplastic (solid tumors)	0.996(DB01181;­METXBIODB00963) 0.995(DB00648) 0.992(METXBIODB03049)	0.997(DBMET01127) 0.993(DBMET00022;­DBMET01077;­METXBIODB00965) 0.992(DBMET00024;­METXBIODB00966 )
HIV-1 integrase inhibitor	0.800(CHEMBL1229211;­DB08930) 0.769(DB11751) 0.505(METXBIODB02170)	0.902(DBMET03078) 0.838(CHEMBL3526572;­DBMET01873) 0.769(DBMET03246;­DBMET03247 )
Antineoplastic (myeloid leukemia)	0.972(CHEMBL820) 0.968(DB15694) 0.953(CHEMBL727;­DB13345)	0.968(DBMET03186) 0.944(METXBIODB00477) 0.941(METXBIODB00476 )
Phosphatidylinositol 3-kinase beta inhibitor	0.596(METXBIODB01339) 0.518(DB12483) 0.439(DB12015)	0.588(DBMET03731) 0.485(DBMET03730) 0.433(DBMET03734 )
I kappa B kinase 1 inhibitor	0.352(DB06824) 0.295(METXBIODB00935) 0.257(DB00909)	0.367(CHEMBL3544897;­CHEMBL3544898) 0.346(CHEMBL244377) 0.328(DBMET02585 )
Antiprotozoal	0.995(DB06697) 0.994(DB11638;­METXBIODB00454) 0.987(DB09274;­METXBIODB01712)	0.994(DBMET00443;­DBMET00793;­METXBIODB00455;­METXBIODB00457;­METXBIODB01713) 0.983(DBMET00827) 0.973(CHEMBL3544736 )
CDK9/cyclin T1 inhibitor	0.301(METXBIODB02968) 0.212(DB09073) 0.203(METXBIODB00896)	0.326(DBMET03719) 0.260(DBMET03713) 0.238(DBMET03710 )
Epidermal growth factor antagonist	0.993(METXBIODB01643) 0.911(DB11963) 0.881(DB00530)	0.875(CHEMBL3706540;­DBMET01123) 0.871(DBMET02190) 0.830(CHEMBL1593;­DBMET00658 )
Antineoplastic (carcinoma)	0.889(CHEMBL92;­DB01248) 0.886(CHEMBL428647;­DB01229) 0.884(METXBIODB00685)	0.889(DBMET00633) 0.883(DBMET00999;­METXBIODB00687) 0.881(DBMET00998 )
ErbB-2 antagonist	0.891(CHEMBL554) 0.800(DB11963) 0.784(DB00530)	0.993(CHEMBL3706540;­DBMET01123) 0.987(CHEMBL1593;­DBMET00658) 0.979(CHEMBL525;­DBMET01147 )
Ephrin antagonist	0.676(METXBIODB01339) 0.635(DB09185) 0.522(DB00530;­METXBIODB00866)	0.531(DBMET03493) 0.501(DBMET00935) 0.492(DB09401 )
Epidermal growth factor receptor kinase inhibitor	0.937(DB00530) 0.918(DB11963) 0.907(METXBIODB03041)	0.896(DBMET02190) 0.868(DBMET01790) 0.762(DBMET00935;­METXBIODB00867 )
Antileukemic	0.965(CHEMBL88;­DB00531;­METXBIODB00960) 0.949(DB01181;­METXBIODB00963) 0.945(DB12902;­METXBIODB00967)	0.993(CHEMBL87658;­DBMET00020;­DBMET00021;­METXBIODB00961;­METXBIODB00964) 0.971(METXBIODB00716) 0.967(CHEMBL731;­DBMET00019 )
Angiogenesis inhibitor	0.935(CHEMBL428647;­DB01229) 0.934(CHEMBL377300) 0.924(DB06697)	0.970(CHEMBL3527569) 0.963(CHEMBL3526270) 0.958(CHEMBL3527397 )
Antimitotic	0.991(CHEMBL428647;­CHEMBL92;­DB01229;­DB01248) 0.988(DB06772) 0.983(METXBIODB01414)	0.991(DBMET00633) 0.987(DBMET00998) 0.986(CHEMBL122465;­CHEMBL307088;­DBMET01760 )
Activity	Pa-Pi (Parent compound)	Pa-Pi (Metabolite compound)