Min Pa: Min Pa(max): Activity's type:

Ext Pa Pi Pmax Activity Other Results ID Pa_max
0.6140.0070.614Antimitotic

0.306 0.042 CHEMBL474163

0.249 0.06 CHEMBL886

0.23 0.068 CHEMBL3544571

0.6350.0420.635Apoptosis agonist

0.576 0.055 CHEMBL917

0.595 0.05 CHEMBL54918

0.577 0.054 CHEMBL474163

0.558 0.058 CHEMBL886

0.505 0.073 CHEMBL590981

0.48 0.081 CHEMBL1774

0.5460.010.989DNA synthesis inhibitor

0.915 0.002 CHEMBL917

0.911 0.002 CHEMBL54918

0.966 0.001 CHEMBL474163

0.369 0.026 CHEMBL219497

0.968 0.001 CHEMBL886

0.985 0.001 CHEMBL590981

0.295 0.045 CHEMBL3544570

0.307 0.041 CHEMBL3544571

0.989 0.001 CHEMBL1774

CHEMBL1774
0.50.0340.5Ca2+/calmodulin-dependent protein kinase kinase A inhibitor

0.42 0.084 CHEMBL219497

0.334 0.169 CHEMBL3544570

0.343 0.158 CHEMBL3544571

0.4660.0430.555Immunosuppressant

0.455 0.046 CHEMBL917

0.453 0.046 CHEMBL54918

0.555 0.02 CHEMBL474163

0.553 0.02 CHEMBL886

0.494 0.035 CHEMBL590981

0.228 0.168 CHEMBL3544570

0.353 0.085 CHEMBL3544571

0.485 0.037 CHEMBL1774

CHEMBL474163
0.4180.0540.418GABA C receptor rho-3 antagonist

0.358 0.081 CHEMBL219497

0.258 0.147 CHEMBL3544570

0.397 0.063 CHEMBL3544571

0.3630.0370.613DNA damaging

0.613 0.008 CHEMBL917

0.533 0.011 CHEMBL54918

0.429 0.022 CHEMBL474163

0.502 0.014 CHEMBL886

0.424 0.023 CHEMBL590981

0.373 0.035 CHEMBL1774

CHEMBL917
0.3470.0240.909RNA-directed DNA polymerase inhibitor

0.672 0.003 CHEMBL917

0.655 0.003 CHEMBL54918

0.806 0.001 CHEMBL474163

0.476 0.012 CHEMBL219497

0.836 0.001 CHEMBL886

0.889 0.001 CHEMBL590981

0.174 0.144 CHEMBL3544570

0.223 0.071 CHEMBL3544571

0.909 0.001 CHEMBL1774

CHEMBL1774
0.330.0130.33Tumour necrosis factor antagonist

0.163 0.085 CHEMBL219497

0.2670.0120.74UDP-glucose 4-epimerase inhibitor

0.604 0.001 CHEMBL917

0.612 0.001 CHEMBL54918

0.697 0 CHEMBL474163

0.375 0.007 CHEMBL219497

0.689 0 CHEMBL886

0.729 0 CHEMBL590981

0.112 0.049 CHEMBL3544570

0.166 0.024 CHEMBL3544571

0.74 0 CHEMBL1774

CHEMBL1774
0.2720.020.272Nitric-oxide synthase stimulant

0.172 0.148 CHEMBL54918

0.193 0.101 CHEMBL219497

0.185 0.117 CHEMBL3544570

0.23 0.049 CHEMBL3544571

0.2540.0130.397Ferrochelatase inhibitor

0.183 0.027 CHEMBL219497

0.247 0.014 CHEMBL3544570

0.397 0.004 CHEMBL3544571

CHEMBL3544571
0.2440.0070.938Antimetabolite

0.728 0.001 CHEMBL917

0.725 0.001 CHEMBL54918

0.896 0.001 CHEMBL474163

0.101 0.016 CHEMBL219497

0.897 0.001 CHEMBL886

0.934 0.001 CHEMBL590981

0.112 0.015 CHEMBL3544570

0.113 0.015 CHEMBL3544571

0.938 0.001 CHEMBL1774

CHEMBL1774
0.2610.0270.956Cytidine deaminase inhibitor

0.769 0.002 CHEMBL917

0.771 0.002 CHEMBL54918

0.863 0.002 CHEMBL474163

0.161 0.068 CHEMBL219497

0.861 0.002 CHEMBL886

0.93 0.001 CHEMBL590981

0.956 0.001 CHEMBL1774

CHEMBL1774
0.3390.1080.578Antibacterial

0.572 0.024 CHEMBL917

0.578 0.023 CHEMBL54918

0.563 0.026 CHEMBL474163

0.556 0.027 CHEMBL886

0.543 0.03 CHEMBL590981

0.302 0.134 CHEMBL3544570

0.435 0.062 CHEMBL3544571

0.512 0.037 CHEMBL1774

CHEMBL54918
0.2920.0690.365Aldehyde oxidase inhibitor

0.248 0.083 CHEMBL219497

0.15 0.139 CHEMBL3544570

0.365 0.052 CHEMBL3544571

CHEMBL3544571
0.2270.0120.758UDP-N-acetylglucosamine 1-carboxyvinyltransferase inhibitor

0.493 0.003 CHEMBL917

0.625 0.001 CHEMBL54918

0.746 0.001 CHEMBL474163

0.139 0.03 CHEMBL219497

0.648 0.001 CHEMBL886

0.758 0 CHEMBL590981

0.131 0.034 CHEMBL3544570

0.22 0.013 CHEMBL3544571

0.746 0.001 CHEMBL1774

CHEMBL590981
0.2330.0190.654Alkylator

0.543 0.004 CHEMBL917

0.483 0.005 CHEMBL54918

0.608 0.004 CHEMBL474163

0.654 0.003 CHEMBL886

0.555 0.004 CHEMBL590981

0.131 0.058 CHEMBL3544570

0.096 0.094 CHEMBL3544571

0.506 0.005 CHEMBL1774

CHEMBL886
0.2050.0020.745Thymidine phosphorylase inhibitor

0.745 0.001 CHEMBL917

0.719 0.001 CHEMBL54918

0.597 0.001 CHEMBL474163

0.038 0.007 CHEMBL219497

0.632 0.001 CHEMBL886

0.383 0.001 CHEMBL590981

0.337 0.001 CHEMBL1774

CHEMBL917
0.2080.0190.725GABA C receptor agonist

0.195 0.021 CHEMBL219497

0.457 0.004 CHEMBL3544570

0.725 0.002 CHEMBL3544571

CHEMBL3544571
0.2450.0590.288Anticonvulsant

0.288 0.044 CHEMBL54918

0.15 0.129 CHEMBL474163

CHEMBL54918
0.1890.0150.647DNA directed RNA polymerase inhibitor

0.371 0.005 CHEMBL917

0.338 0.006 CHEMBL54918

0.459 0.004 CHEMBL474163

0.109 0.047 CHEMBL219497

0.486 0.004 CHEMBL886

0.595 0.004 CHEMBL590981

0.647 0.003 CHEMBL1774

CHEMBL1774
0.1890.0180.1895 Hydroxytryptamine 3A agonist

0.126 0.051 CHEMBL219497

0.1960.0350.485Alpha-N-acetylglucosaminidase inhibitor

0.26 0.021 CHEMBL917

0.35 0.012 CHEMBL54918

0.21 0.031 CHEMBL219497

0.33 0.013 CHEMBL3544570

0.485 0.005 CHEMBL3544571

CHEMBL3544571
0.2270.0690.413Peptidyltransferase inhibitor

0.413 0.006 CHEMBL917

0.395 0.007 CHEMBL54918

0.337 0.014 CHEMBL474163

0.211 0.085 CHEMBL219497

0.357 0.011 CHEMBL886

0.319 0.019 CHEMBL590981

0.226 0.07 CHEMBL3544570

0.304 0.023 CHEMBL3544571

0.313 0.02 CHEMBL1774

CHEMBL917
0.2440.0870.3645 Hydroxytryptamine uptake stimulant

0.199 0.153 CHEMBL219497

0.249 0.082 CHEMBL3544570

0.364 0.022 CHEMBL3544571

CHEMBL3544571
0.150.0030.506Thymidylate synthase inhibitor

0.305 0.001 CHEMBL917

0.265 0.002 CHEMBL54918

0.453 0.001 CHEMBL474163

0.046 0.033 CHEMBL219497

0.506 0.001 CHEMBL886

0.317 0.001 CHEMBL590981

0.043 0.037 CHEMBL3544571

0.288 0.002 CHEMBL1774

CHEMBL886
0.2010.060.2015 Hydroxytryptamine 3E antagonist

0.174 0.123 CHEMBL219497

0.192 0.077 CHEMBL3544571

0.1510.0140.533HIV-1 reverse transcriptase inhibitor

0.241 0.007 CHEMBL917

0.22 0.008 CHEMBL54918

0.308 0.005 CHEMBL474163

0.325 0.005 CHEMBL886

0.47 0.004 CHEMBL590981

0.533 0.004 CHEMBL1774

CHEMBL1774
0.1290.0020.874Uridine phosphorylase inhibitor

0.683 0 CHEMBL917

0.657 0 CHEMBL54918

0.849 0 CHEMBL474163

0.049 0.008 CHEMBL219497

0.874 0 CHEMBL886

0.565 0 CHEMBL590981

0.025 0.022 CHEMBL3544571

0.526 0 CHEMBL1774

CHEMBL886
0.1640.040.173Nav1.6 sodium channel blocker

0.173 0.033 CHEMBL219497

CHEMBL219497
0.1680.0450.168MAP kinase 3 inhibitor

0.135 0.096 CHEMBL54918

0.1260.0040.126Dihydroorotate oxidase inhibitor

0.069 0.018 CHEMBL219497

0.1260.0130.57Biliverdin reductase inhibitor

0.133 0.012 CHEMBL917

0.297 0.003 CHEMBL54918

0.55 0.001 CHEMBL474163

0.106 0.017 CHEMBL219497

0.394 0.002 CHEMBL886

0.57 0.001 CHEMBL590981

0.104 0.017 CHEMBL3544570

0.185 0.007 CHEMBL3544571

0.55 0.001 CHEMBL1774

CHEMBL590981
0.2040.090.447Cyclic AMP phosphodiesterase inhibitor

0.22 0.08 CHEMBL917

0.447 0.011 CHEMBL54918

0.247 0.065 CHEMBL474163

0.229 0.075 CHEMBL219497

CHEMBL54918
0.1660.0550.166GABA C receptor rho-2 antagonist

0.135 0.096 CHEMBL219497

0.153 0.07 CHEMBL3544571

0.190.080.302Anesthetic general

0.193 0.078 CHEMBL474163

0.141 0.124 CHEMBL219497

0.163 0.101 CHEMBL886

0.302 0.032 CHEMBL3544570

0.206 0.071 CHEMBL3544571

CHEMBL3544570
0.1320.0230.753NADH dehydrogenase inhibitor

0.503 0.003 CHEMBL917

0.542 0.003 CHEMBL54918

0.702 0.001 CHEMBL474163

0.131 0.023 CHEMBL219497

0.674 0.001 CHEMBL886

0.753 0.001 CHEMBL590981

0.12 0.028 CHEMBL3544570

0.183 0.012 CHEMBL3544571

0.737 0.001 CHEMBL1774

CHEMBL590981
0.1740.0670.429Peroxidase inhibitor

0.429 0.017 CHEMBL3544570

0.419 0.018 CHEMBL3544571

CHEMBL3544570
0.1290.0250.189Thioredoxin inhibitor

0.189 0.009 CHEMBL917

0.125 0.028 CHEMBL54918

0.104 0.043 CHEMBL886

CHEMBL917
0.1110.0090.137Phospholipase D inhibitor

0.137 0.004 CHEMBL219497

0.077 0.039 CHEMBL590981

0.069 0.056 CHEMBL3544570

0.08 0.034 CHEMBL3544571

0.07 0.054 CHEMBL1774

CHEMBL219497
0.2080.1080.431Superoxide dismutase inhibitor

0.179 0.143 CHEMBL219497

0.392 0.028 CHEMBL3544570

0.431 0.022 CHEMBL3544571

CHEMBL3544571
0.1160.0230.116Keratolytic

0.088 0.04 CHEMBL3544570

0.096 0.033 CHEMBL3544571

0.1040.0130.768Mannitol-1-phosphate 5-dehydrogenase inhibitor

0.458 0.001 CHEMBL917

0.493 0.001 CHEMBL54918

0.675 0 CHEMBL474163

0.072 0.025 CHEMBL219497

0.634 0.001 CHEMBL886

0.746 0 CHEMBL590981

0.057 0.038 CHEMBL3544570

0.091 0.016 CHEMBL3544571

0.768 0 CHEMBL1774

CHEMBL1774
0.1360.0460.469DNA repair enzyme inhibitor

0.359 0.004 CHEMBL917

0.347 0.004 CHEMBL54918

0.456 0.003 CHEMBL474163

0.163 0.021 CHEMBL219497

0.469 0.003 CHEMBL886

0.259 0.005 CHEMBL590981

0.107 0.105 CHEMBL3544571

0.227 0.006 CHEMBL1774

CHEMBL886
0.1190.0290.119Alpha 1b adrenoreceptor antagonist
0.1030.0170.103Secretase beta inhibitor

0.075 0.042 CHEMBL219497

0.2890.2060.849Caspase 9 stimulant

0.568 0.041 CHEMBL917

0.749 0.018 CHEMBL54918

0.849 0.005 CHEMBL474163

0.795 0.012 CHEMBL886

0.702 0.024 CHEMBL590981

0.287 0.208 CHEMBL3544571

0.629 0.032 CHEMBL1774

CHEMBL474163
0.1250.0450.132Protein kinase (CK2) inhibitor

0.132 0.041 CHEMBL219497

CHEMBL219497
0.1260.0460.282GABA C receptor antagonist

0.102 0.075 CHEMBL219497

0.138 0.037 CHEMBL3544570

0.282 0.005 CHEMBL3544571

CHEMBL3544571
0.0870.0080.962Thymidine kinase inhibitor

0.758 0.001 CHEMBL917

0.696 0.001 CHEMBL54918

0.895 0.001 CHEMBL474163

0.085 0.008 CHEMBL219497

0.925 0 CHEMBL886

0.954 0 CHEMBL590981

0.962 0 CHEMBL1774

CHEMBL1774
0.10.0230.1Alpha 1d adrenoreceptor antagonist
0.1990.1220.3955 Hydroxytryptamine release stimulant

0.395 0.047 CHEMBL3544571

CHEMBL3544571
0.0780.0040.078Kainate receptor agonist

0.049 0.015 CHEMBL219497

0.05 0.014 CHEMBL3544570

0.07 0.004 CHEMBL3544571

0.1110.0380.356Triose-phosphate isomerase inhibitor

0.102 0.045 CHEMBL917

0.141 0.023 CHEMBL54918

0.356 0.004 CHEMBL474163

0.088 0.063 CHEMBL219497

0.251 0.007 CHEMBL886

0.193 0.012 CHEMBL590981

0.155 0.019 CHEMBL3544570

0.248 0.007 CHEMBL3544571

0.171 0.015 CHEMBL1774

CHEMBL474163
0.1430.0710.251Mannose-6-phosphate isomerase inhibitor

0.251 0.012 CHEMBL474163

0.192 0.035 CHEMBL886

0.146 0.068 CHEMBL590981

0.126 0.091 CHEMBL1774

CHEMBL474163
0.1730.1020.173MAP kinase kinase 2 inhibitor
0.110.0420.298Alcohol dehydrogenase inhibitor

0.115 0.038 CHEMBL54918

0.251 0.008 CHEMBL474163

0.106 0.046 CHEMBL886

0.298 0.005 CHEMBL590981

0.112 0.041 CHEMBL3544571

0.253 0.007 CHEMBL1774

CHEMBL590981
0.090.0240.712Carbamoyl phosphate synthetase inhibitor

0.181 0.008 CHEMBL917

0.375 0.003 CHEMBL54918

0.655 0.001 CHEMBL474163

0.086 0.026 CHEMBL219497

0.536 0.002 CHEMBL886

0.699 0.001 CHEMBL590981

0.265 0.005 CHEMBL3544570

0.214 0.007 CHEMBL3544571

0.712 0.001 CHEMBL1774

CHEMBL1774
0.0890.0220.832Argininosuccinate synthase inhibitor

0.362 0.003 CHEMBL917

0.363 0.003 CHEMBL54918

0.75 0.001 CHEMBL474163

0.064 0.034 CHEMBL219497

0.749 0.001 CHEMBL886

0.813 0.001 CHEMBL590981

0.117 0.016 CHEMBL3544570

0.183 0.009 CHEMBL3544571

0.832 0 CHEMBL1774

CHEMBL1774
0.2680.2030.3885 Hydroxytryptamine release inhibitor

0.388 0.086 CHEMBL3544571

CHEMBL3544571
0.0680.0040.068Glutamate (mGluR1) agonist

0.028 0.011 CHEMBL3544571

0.0680.0050.084Protein kinase (CK2) beta inhibitor

0.084 0.004 CHEMBL219497

CHEMBL219497
0.1390.0760.158Ca2+-transporting ATPase inhibitor

0.134 0.101 CHEMBL219497

0.133 0.103 CHEMBL3544570

0.158 0.026 CHEMBL3544571

CHEMBL3544571
0.2040.1420.254Gastrin inhibitor

0.254 0.074 CHEMBL3544570

0.184 0.173 CHEMBL3544571

CHEMBL3544570
0.1010.040.101Interleukin 5 antagonist
0.0740.0140.074Glutamate (mGluR group I) agonist

0.044 0.038 CHEMBL219497

0.1110.0520.543Adenylate kinase inhibitor

0.149 0.027 CHEMBL917

0.314 0.006 CHEMBL54918

0.494 0.001 CHEMBL474163

0.102 0.064 CHEMBL219497

0.388 0.004 CHEMBL886

0.531 0.001 CHEMBL590981

0.285 0.008 CHEMBL3544570

0.279 0.008 CHEMBL3544571

0.543 0.001 CHEMBL1774

CHEMBL1774
0.1070.0530.22GABA C receptor rho-1 antagonist

0.09 0.078 CHEMBL219497

0.119 0.041 CHEMBL3544570

0.22 0.005 CHEMBL3544571

CHEMBL3544571
0.060.0060.06Calcitonin gene-related peptide antagonist

0.06 0.006 CHEMBL219497

0.1090.0560.109Nav1.1 sodium channel blocker
0.0840.0310.084Acetylcholine M5 receptor agonist

0.083 0.032 CHEMBL219497

0.0980.0480.13Pim-3 kinase inhibitor

0.13 0.026 CHEMBL219497

CHEMBL219497
0.1160.0670.182Interleukin 8 antagonist

0.182 0.018 CHEMBL917

CHEMBL917
0.0860.0380.803Phosphofructokinase-1 inhibitor

0.291 0.006 CHEMBL917

0.455 0.003 CHEMBL54918

0.699 0.001 CHEMBL474163

0.067 0.05 CHEMBL219497

0.515 0.002 CHEMBL886

0.777 0.001 CHEMBL590981

0.122 0.025 CHEMBL3544570

0.195 0.012 CHEMBL3544571

0.803 0.001 CHEMBL1774

CHEMBL1774
0.0590.0110.059Nicotinic acid receptor agonist
0.1080.0610.164DOPA decarboxylase inhibitor

0.111 0.057 CHEMBL3544570

0.164 0.015 CHEMBL3544571

CHEMBL3544571
0.0510.0030.051Acid ceramidase inhibitor

0.026 0.015 CHEMBL219497

0.1110.0660.111MAP kinase 13 inhibitor
0.0490.0040.049Nicotinic acid receptor 2 antagonist

0.039 0.005 CHEMBL219497

0.080.0350.085Phosphodiesterase III inhibitor

0.085 0.032 CHEMBL219497

CHEMBL219497
0.0730.0320.073MDM2 inhibitor
0.0970.0580.141Phosphodiesterase 6D inhibitor

0.122 0.024 CHEMBL917

0.141 0.012 CHEMBL54918

CHEMBL54918
0.0570.0180.057Dihydroorotase inhibitor
0.0740.0360.079Glutamate (mGluR7) antagonist

0.079 0.029 CHEMBL3544571

CHEMBL3544571
0.0680.030.62Alcohol oxidase inhibitor

0.351 0.004 CHEMBL3544570

0.62 0.003 CHEMBL3544571

CHEMBL3544571
0.0690.0320.069Collagenase 3 inhibitor
0.0490.0140.049Nicotinic acid receptor 2 agonist
0.0640.030.238Aldose reductase inhibitor

0.131 0.013 CHEMBL3544570

0.238 0.005 CHEMBL3544571

CHEMBL3544571
0.0620.0270.062Pregnane X receptor antagonist
0.0960.0630.194Electrolyte absorption antagonist

0.194 0.009 CHEMBL3544570

0.13 0.029 CHEMBL3544571

CHEMBL3544570
0.1480.1150.291Succinate dehydrogenase inhibitor

0.207 0.044 CHEMBL3544570

0.291 0.012 CHEMBL3544571

CHEMBL3544571
0.0520.020.197AICAR transformylase inhibitor

0.05 0.023 CHEMBL917

0.097 0.005 CHEMBL54918

0.197 0.002 CHEMBL474163

0.054 0.018 CHEMBL219497

0.12 0.004 CHEMBL886

0.136 0.003 CHEMBL590981

0.04 0.039 CHEMBL3544570

0.057 0.016 CHEMBL3544571

0.123 0.004 CHEMBL1774

CHEMBL474163
0.0430.0110.194Hypoxanthine phosphoribosyltransferase inhibitor

0.061 0.007 CHEMBL917

0.097 0.003 CHEMBL54918

0.158 0.001 CHEMBL474163

0.038 0.013 CHEMBL219497

0.107 0.002 CHEMBL886

0.185 0.001 CHEMBL590981

0.029 0.018 CHEMBL3544571

0.194 0.001 CHEMBL1774

CHEMBL1774
0.0570.0270.989Phosphorylase inhibitor

0.413 0.003 CHEMBL917

0.634 0.002 CHEMBL54918

0.92 0.001 CHEMBL474163

0.747 0.002 CHEMBL886

0.985 0.001 CHEMBL590981

0.989 0.001 CHEMBL1774

CHEMBL1774
0.1880.1580.384Tyrosine 3 hydroxylase inhibitor

0.21 0.119 CHEMBL219497

0.296 0.035 CHEMBL3544570

0.384 0.01 CHEMBL3544571

CHEMBL3544571
0.050.0210.051Dipeptidyl peptidase IV inhibitor

0.051 0.02 CHEMBL219497

CHEMBL219497
0.0580.0290.08Dipeptidyl peptidase inhibitor

0.08 0.014 CHEMBL219497

CHEMBL219497
0.0560.0280.073Phosphodiesterase 7A inhibitor

0.073 0.009 CHEMBL219497

CHEMBL219497
0.1020.0740.149Cystathionine beta-synthase inhibitor

0.149 0.041 CHEMBL3544571

CHEMBL3544571
0.0340.0080.466Thymidine kinase (Herpes simplex virus 1) inhibitor

0.466 0.001 CHEMBL917

0.393 0.001 CHEMBL54918

0.356 0.001 CHEMBL474163

0.045 0.004 CHEMBL219497

0.419 0.001 CHEMBL886

0.167 0.002 CHEMBL590981

0.138 0.002 CHEMBL1774

CHEMBL917
0.0740.0480.074Alpha 1a adrenoreceptor antagonist
0.0870.0620.087Bromodomain-containing protein 2 inhibitor
0.0750.0510.187Catalase inhibitor

0.187 0.018 CHEMBL3544570

0.175 0.02 CHEMBL3544571

CHEMBL3544570
0.0280.0050.277Thymidine kinase (Herpes simplex virus 2) inhibitor

0.277 0.001 CHEMBL917

0.084 0.002 CHEMBL54918

0.022 0.01 CHEMBL474163

0.039 0.003 CHEMBL219497

0.04 0.003 CHEMBL886

CHEMBL917
0.080.0570.121Glycine receptor antagonist

0.121 0.017 CHEMBL219497

0.086 0.048 CHEMBL3544570

0.089 0.044 CHEMBL3544571

CHEMBL219497
0.0740.0510.818Glutamate dehydrogenase inhibitor

0.11 0.026 CHEMBL917

0.237 0.008 CHEMBL54918

0.728 0.002 CHEMBL474163

0.421 0.004 CHEMBL886

0.802 0.001 CHEMBL590981

0.257 0.007 CHEMBL3544570

0.272 0.006 CHEMBL3544571

0.818 0.001 CHEMBL1774

CHEMBL1774
0.0330.010.033DNA polymerase III inhibitor

0.031 0.014 CHEMBL219497

0.0530.0310.056Adenosine A2b receptor antagonist

0.056 0.027 CHEMBL54918

CHEMBL54918
0.0450.0230.045Nicotinic acid receptor 1 agonist
0.0980.0760.098DNA intercalator
0.0550.0350.811Ornithine carbamoyltransferase inhibitor

0.095 0.017 CHEMBL917

0.218 0.006 CHEMBL54918

0.694 0.002 CHEMBL474163

0.047 0.043 CHEMBL219497

0.371 0.003 CHEMBL886

0.789 0.001 CHEMBL590981

0.238 0.005 CHEMBL3544570

0.195 0.007 CHEMBL3544571

0.811 0.001 CHEMBL1774

CHEMBL1774
0.090.0710.102MAP kinase kinase 1 inhibitor

0.102 0.054 CHEMBL219497

0.085 0.078 CHEMBL3544571

CHEMBL219497
0.1060.0880.107MAP kinase kinase inhibitor

0.107 0.088 CHEMBL219497

CHEMBL219497
0.1420.1230.191Neurotensin receptor agonist

0.163 0.074 CHEMBL3544570

0.191 0.04 CHEMBL3544571

CHEMBL3544571
0.0240.0060.024Calcitonin gene-related peptide 1 receptor antagonist

0.021 0.008 CHEMBL219497

0.0280.010.035Glutamate (mGluR1a) agonist

0.021 0.017 CHEMBL3544570

0.035 0.007 CHEMBL3544571

CHEMBL3544571
0.1280.110.269Growth hormone agonist

0.126 0.111 CHEMBL219497

0.123 0.116 CHEMBL3544570

0.269 0.039 CHEMBL3544571

CHEMBL3544571
0.0860.0690.144HIV-1 integrase (Overall Integration) inhibitor

0.082 0.075 CHEMBL3544570

0.144 0.027 CHEMBL3544571

CHEMBL3544571
0.0520.0350.476Aconitate hydratase inhibitor

0.048 0.043 CHEMBL219497

0.459 0.002 CHEMBL3544570

0.476 0.002 CHEMBL3544571

CHEMBL3544571
0.0350.0180.035Methionyl aminopeptidase 1 inhibitor
0.190.1730.295Insulysin inhibitor

0.253 0.093 CHEMBL3544570

0.295 0.062 CHEMBL3544571

CHEMBL3544571
0.0210.0060.021Thyroid hormone alpha agonist

0.017 0.011 CHEMBL219497

0.2120.1960.323Calcium channel activator

0.21 0.198 CHEMBL474163

0.306 0.086 CHEMBL219497

0.323 0.07 CHEMBL3544571

CHEMBL3544571
0.0360.0220.88Fumarate hydratase inhibitor

0.08 0.007 CHEMBL917

0.302 0.003 CHEMBL54918

0.814 0.001 CHEMBL474163

0.031 0.027 CHEMBL219497

0.541 0.002 CHEMBL886

0.865 0.001 CHEMBL590981

0.047 0.014 CHEMBL3544570

0.096 0.005 CHEMBL3544571

0.88 0 CHEMBL1774

CHEMBL1774
0.0880.0730.088Phosphodiesterase 7B inhibitor
0.0290.0140.035Integrin alpha2beta1 antagonist

0.035 0.008 CHEMBL54918

0.026 0.019 CHEMBL3544570

CHEMBL54918
0.0660.0520.083Exportin-1 inhibitor

0.083 0.021 CHEMBL219497

0.069 0.046 CHEMBL3544570

0.082 0.023 CHEMBL3544571

CHEMBL219497
0.0430.030.049Histamine H2 receptor agonist

0.049 0.023 CHEMBL3544570

CHEMBL3544570
0.0380.0240.041Integrin alpha2 antagonist

0.041 0.019 CHEMBL54918

0.036 0.027 CHEMBL3544570

CHEMBL54918
0.0880.0750.178Creatine kinase inhibitor

0.098 0.062 CHEMBL3544570

0.178 0.015 CHEMBL3544571

CHEMBL3544571
0.0580.0460.058Phosphodiesterase 1A inhibitor
0.0690.0570.403Porphobilinogen synthase inhibitor

0.122 0.028 CHEMBL3544570

0.403 0.004 CHEMBL3544571

CHEMBL3544571
0.0340.0230.231Purinergic P2Y2 antagonist

0.056 0.009 CHEMBL917

0.092 0.004 CHEMBL54918

0.18 0.002 CHEMBL474163

0.156 0.003 CHEMBL886

0.219 0.001 CHEMBL590981

0.231 0.001 CHEMBL1774

CHEMBL1774
0.0350.0250.035AMPA receptor agonist
0.0890.080.165Anabolic

0.105 0.056 CHEMBL54918

0.147 0.02 CHEMBL474163

0.128 0.032 CHEMBL886

0.16 0.013 CHEMBL590981

0.107 0.054 CHEMBL3544571

0.165 0.011 CHEMBL1774

CHEMBL1774
0.0150.0060.015DNA polymerase III polC-type inhibitor

0.013 0.01 CHEMBL219497

0.1360.1280.136ATPase inhibitor
0.0470.0380.064Dopamine beta hydroxylase inhibitor

0.064 0.011 CHEMBL3544571

CHEMBL3544571
0.0690.0610.086S-adenosyl-L-methionine decarboxylase inhibitor

0.07 0.059 CHEMBL54918

0.086 0.028 CHEMBL3544571

CHEMBL3544571
0.0120.0050.637Purinergic P2Y2 agonist

0.052 0.001 CHEMBL917

0.067 0 CHEMBL54918

0.433 0 CHEMBL474163

0.01 0.007 CHEMBL219497

0.362 0 CHEMBL886

0.582 0 CHEMBL590981

0.637 0 CHEMBL1774

CHEMBL1774
0.1020.0950.125Nav1.3 sodium channel blocker

0.125 0.069 CHEMBL219497

CHEMBL219497
0.0670.0610.067Alpha 1 adrenoreceptor antagonist
0.0580.0520.083Corticotropin releasing factor 2 receptor antagonist

0.075 0.022 CHEMBL590981

0.083 0.015 CHEMBL1774

CHEMBL1774
0.0980.0920.098CDK3/cyclin E inhibitor
0.010.0040.01DNA topoisomerase III inhibitor

0.009 0.004 CHEMBL219497

0.0550.050.071TRPA1 antagonist

0.071 0.031 CHEMBL219497

CHEMBL219497
0.0520.0480.052Raf kinase B inhibitor
0.1280.1240.128CF transmembrane conductance regulator agonist
0.0560.0520.086Phosphodiesterase VII inhibitor

0.086 0.021 CHEMBL219497

CHEMBL219497
0.1340.1310.1343C-like protease (Human coronavirus) inhibitor
0.0620.0610.115Glutamate (mGluR6) antagonist

0.078 0.026 CHEMBL3544570

0.115 0.006 CHEMBL3544571

CHEMBL3544571
0.1230.1220.123Heat shock protein 90 alpha antagonist
0.0430.0430.108Glucose-6-phosphate isomerase inhibitor

0.049 0.03 CHEMBL917

0.06 0.018 CHEMBL54918

0.108 0.004 CHEMBL474163

0.088 0.007 CHEMBL886

0.074 0.011 CHEMBL590981

0.059 0.019 CHEMBL3544570

0.081 0.009 CHEMBL3544571

0.069 0.013 CHEMBL1774

CHEMBL474163
0.010.0110.025Purine nucleoside phosphorylase inhibitor

0.015 0.005 CHEMBL54918

0.019 0.004 CHEMBL474163

0.012 0.008 CHEMBL886

0.025 0.003 CHEMBL590981

0.022 0.003 CHEMBL1774

CHEMBL590981
0.0770.0780.092D-Ala-D-Ala ligase inhibitor

0.092 0.04 CHEMBL3544571

CHEMBL3544571
0.0120.0130.715Purinergic receptor agonist

0.045 0.003 CHEMBL917

0.06 0.002 CHEMBL54918

0.157 0.001 CHEMBL474163

0.115 0.001 CHEMBL886

0.534 0.001 CHEMBL590981

0.715 0.001 CHEMBL1774

CHEMBL1774
0.0120.0130.715Purinergic P2 agonist

0.045 0.003 CHEMBL917

0.06 0.002 CHEMBL54918

0.157 0.001 CHEMBL474163

0.115 0.001 CHEMBL886

0.534 0.001 CHEMBL590981

0.715 0.001 CHEMBL1774

CHEMBL1774
0.0020.0030.44Purinergic P2Y6 agonist

0.028 0 CHEMBL917

0.04 0 CHEMBL54918

0.245 0 CHEMBL474163

0.19 0 CHEMBL886

0.373 0 CHEMBL590981

0.44 0 CHEMBL1774

CHEMBL1774
0.1130.1160.197Sphingosine 1-phosphate receptor 2 antagonist

0.197 0.008 CHEMBL3544570

0.18 0.015 CHEMBL3544571

CHEMBL3544570
0.0090.0130.713Purinergic P2Y agonist

0.039 0.003 CHEMBL917

0.052 0.002 CHEMBL54918

0.145 0.001 CHEMBL474163

0.107 0.001 CHEMBL886

0.528 0.001 CHEMBL590981

0.713 0.001 CHEMBL1774

CHEMBL1774
0.0980.1020.67Aldehyde dehydrogenase inhibitor

0.183 0.032 CHEMBL54918

0.529 0.004 CHEMBL474163

0.22 0.023 CHEMBL886

0.67 0.003 CHEMBL590981

0.139 0.055 CHEMBL3544571

0.626 0.003 CHEMBL1774

CHEMBL590981
0.0220.0260.053Thyroid hormone agonist

0.031 0.012 CHEMBL3544570

0.053 0.004 CHEMBL3544571

CHEMBL3544571
0.120.1240.142Sphingosine 1-phosphate receptor 5 antagonist

0.142 0.076 CHEMBL3544571

CHEMBL3544571
0.050.0550.096Carbonic anhydrase stimulant

0.096 0.02 CHEMBL3544570

0.094 0.02 CHEMBL3544571

CHEMBL3544570
0.0020.0070.456Purinergic P2Y4 agonist

0.007 0.002 CHEMBL917

0.01 0.001 CHEMBL54918

0.036 0.001 CHEMBL474163

0.023 0.001 CHEMBL886

0.327 0 CHEMBL590981

0.456 0 CHEMBL1774

CHEMBL1774
0.0560.0640.262Phenylalanine 4-hydroxylase inhibitor

0.093 0.029 CHEMBL3544570

0.262 0.005 CHEMBL3544571

CHEMBL3544571
0.0370.0460.055Glutamate (mGluR4) antagonist

0.055 0.017 CHEMBL3544571

CHEMBL3544571
0.0430.0520.278Acyl-CoA dehydrogenase inhibitor

0.06 0.033 CHEMBL917

0.123 0.012 CHEMBL54918

0.252 0.003 CHEMBL474163

0.193 0.006 CHEMBL886

0.278 0.002 CHEMBL590981

0.1 0.016 CHEMBL3544570

0.171 0.007 CHEMBL3544571

0.27 0.002 CHEMBL1774

CHEMBL590981
0.0880.0970.697Adenylate cyclase inhibitor

0.46 0.006 CHEMBL917

0.449 0.006 CHEMBL54918

0.642 0.003 CHEMBL474163

0.645 0.003 CHEMBL886

0.684 0.002 CHEMBL590981

0.106 0.079 CHEMBL3544571

0.697 0.002 CHEMBL1774

CHEMBL1774
0.0810.090.089Lanosterol 14 alpha demethylase inhibitor

0.089 0.074 CHEMBL3544571

CHEMBL3544571
0.0570.0670.268Histidine decarboxylase inhibitor

0.201 0.013 CHEMBL3544570

0.268 0.008 CHEMBL3544571

CHEMBL3544571
0.0230.0340.036Nicotinic alpha3beta4 receptor agonist

0.036 0.013 CHEMBL219497

CHEMBL219497
0.1080.1190.177Cell wall synthesis inhibitor

0.176 0.042 CHEMBL54918

0.177 0.042 CHEMBL474163

0.113 0.11 CHEMBL219497

0.177 0.042 CHEMBL590981

0.13 0.085 CHEMBL3544570

0.153 0.063 CHEMBL3544571

0.155 0.061 CHEMBL1774

CHEMBL590981
0.060.070.262Glutamate decarboxylase inhibitor

0.199 0.007 CHEMBL3544570

0.262 0.004 CHEMBL3544571

CHEMBL3544571
0.0490.0590.081Androgen agonist

0.081 0.024 CHEMBL219497

CHEMBL219497
0.0380.050.042Glutamate (mGluR5) agonist

0.042 0.038 CHEMBL219497

CHEMBL219497
0.0080.0230.012Carbonic anhydrase XI inhibitor

0.012 0.011 CHEMBL3544571

CHEMBL3544571
0.0350.050.0553-Hydroxyanthranilate 3,4-dioxygenase inhibitor

0.055 0.01 CHEMBL3544571

CHEMBL3544571
0.0050.020.014Thyroid hormone beta agonist

0.014 0.004 CHEMBL3544571

CHEMBL3544571
0.0610.0780.132Glycine receptor agonist

0.132 0.01 CHEMBL3544571

CHEMBL3544571
0.040.0570.045Bombesin 2 receptor antagonist

0.045 0.043 CHEMBL3544571

CHEMBL3544571
0.0740.0910.311Phosphodiesterase I inhibitor

0.181 0.013 CHEMBL474163

0.091 0.057 CHEMBL886

0.284 0.005 CHEMBL590981

0.311 0.004 CHEMBL1774

CHEMBL1774
0.150.1670.391Interleukin agonist

0.254 0.076 CHEMBL917

0.391 0.02 CHEMBL54918

0.306 0.045 CHEMBL474163

0.167 0.151 CHEMBL886

0.223 0.1 CHEMBL590981

0.291 0.053 CHEMBL3544571

0.192 0.128 CHEMBL1774

CHEMBL54918
0.010.0280.023Kainate receptor 1 antagonist

0.023 0.014 CHEMBL3544571

CHEMBL3544571
0.1160.1350.191Adenylate cyclase stimulant

0.134 0.094 CHEMBL917

0.174 0.031 CHEMBL54918

0.171 0.034 CHEMBL474163

0.131 0.1 CHEMBL886

0.143 0.075 CHEMBL590981

0.15 0.062 CHEMBL3544570

0.191 0.018 CHEMBL3544571

0.133 0.094 CHEMBL1774

CHEMBL3544571
0.0310.050.075Glutamate (mGluR8) agonist

0.045 0.016 CHEMBL3544570

0.075 0.004 CHEMBL3544571

CHEMBL3544571
0.0350.0540.04CF transmembrane conductance regulator antagonist

0.04 0.028 CHEMBL917

CHEMBL917
0.0260.0460.048Kainate receptor antagonist

0.048 0.023 CHEMBL3544571

CHEMBL3544571
0.0830.1040.099Glutamate (mGluR7) agonist

0.099 0.062 CHEMBL3544571

CHEMBL3544571
0.0970.1180.143Nav1.2 sodium channel blocker

0.143 0.062 CHEMBL219497

CHEMBL219497
0.0180.0410.032Nicotinic alpha4beta2 receptor agonist

0.032 0.014 CHEMBL219497

CHEMBL219497
0.0280.050.042DNA gyrase subunit B inhibitor

0.042 0.02 CHEMBL219497

CHEMBL219497
0.0290.0520.044Tryptophan 5 hydroxylase inhibitor

0.044 0.01 CHEMBL3544571

CHEMBL3544571
0.0430.0670.059Heparanase inhibitor

0.054 0.035 CHEMBL54918

0.059 0.024 CHEMBL474163

0.049 0.048 CHEMBL886

CHEMBL474163
0.0280.0540.063Membrane dipeptidase inhibitor

0.063 0.009 CHEMBL3544570

0.06 0.01 CHEMBL3544571

CHEMBL3544570
0.0090.0350.032Carbonic anhydrase VIII inhibitor

0.032 0.004 CHEMBL3544571

CHEMBL3544571
0.0090.0350.032Carbonic anhydrase X inhibitor

0.032 0.004 CHEMBL3544571

CHEMBL3544571
0.1250.1510.147Lipocortins synthesis antagonist

0.135 0.13 CHEMBL917

0.147 0.109 CHEMBL3544571

CHEMBL3544571
0.0690.0950.226Aminopeptidase B inhibitor

0.209 0.019 CHEMBL3544570

0.226 0.016 CHEMBL3544571

CHEMBL3544571
0.1250.1520.61Heat shock protein 70 antagonist

0.167 0.02 CHEMBL54918

0.311 0.003 CHEMBL474163

0.178 0.013 CHEMBL886

0.536 0.002 CHEMBL590981

0.141 0.071 CHEMBL3544571

0.61 0.002 CHEMBL1774

CHEMBL1774
0.0340.0630.112Carbonic anhydrase VB inhibitor

0.087 0.02 CHEMBL917

0.066 0.03 CHEMBL54918

0.112 0.014 CHEMBL3544571

CHEMBL3544571
0.020.0480.033Kainate receptor 2 antagonist

0.033 0.028 CHEMBL3544571

CHEMBL3544571
0.0260.0540.077Glutamate (mGluR3) antagonist

0.077 0.005 CHEMBL3544571

CHEMBL3544571
0.0230.0530.031Dipeptidyl peptidase II inhibitor

0.031 0.025 CHEMBL3544571

CHEMBL3544571
0.0340.0650.049Glutamate (mGluR group III) antagonist

0.049 0.022 CHEMBL3544571

CHEMBL3544571
0.010.0410.148Purinergic P2Y1 agonist

0.024 0.005 CHEMBL917

0.026 0.004 CHEMBL54918

0.105 0.001 CHEMBL474163

0.093 0.001 CHEMBL886

0.139 0.001 CHEMBL590981

0.018 0.008 CHEMBL3544571

0.148 0.001 CHEMBL1774

CHEMBL1774
0.0140.0440.036Methylmalonyl-CoA mutase inhibitor

0.02 0.008 CHEMBL54918

0.031 0.002 CHEMBL474163

0.025 0.004 CHEMBL886

0.036 0.002 CHEMBL590981

0.017 0.016 CHEMBL3544570

0.021 0.008 CHEMBL3544571

0.034 0.002 CHEMBL1774

CHEMBL590981
0.0410.0730.105NMDA receptor glycine site agonist

0.105 0.014 CHEMBL3544570

0.094 0.019 CHEMBL3544571

CHEMBL3544570
0.020.0520.034Purinergic P2Y15 antagonist

0.034 0.011 CHEMBL54918

0.032 0.013 CHEMBL3544571

CHEMBL54918
0.1410.1730.656Glyceraldehyde-3-phosphate dehydrogenase inhibitor

0.402 0.008 CHEMBL917

0.515 0.004 CHEMBL54918

0.624 0.002 CHEMBL474163

0.519 0.004 CHEMBL886

0.656 0.001 CHEMBL590981

0.199 0.073 CHEMBL3544571

0.645 0.002 CHEMBL1774

CHEMBL590981
0.0490.0820.114Carbonic anhydrase VA inhibitor

0.095 0.027 CHEMBL917

0.114 0.02 CHEMBL54918

0.109 0.021 CHEMBL474163

0.091 0.029 CHEMBL886

0.078 0.038 CHEMBL3544570

0.11 0.021 CHEMBL3544571

CHEMBL54918
0.0380.0740.058Pim-2 kinase inhibitor

0.058 0.033 CHEMBL219497

CHEMBL219497
0.0390.0740.077Alpha-mannosidase inhibitor

0.065 0.021 CHEMBL917

0.077 0.012 CHEMBL54918

0.056 0.033 CHEMBL3544570

0.077 0.013 CHEMBL3544571

CHEMBL3544571
0.0340.070.545Purinergic P2X4 antagonist

0.043 0.037 CHEMBL54918

0.275 0.003 CHEMBL474163

0.092 0.005 CHEMBL886

0.474 0.002 CHEMBL590981

0.545 0.002 CHEMBL1774

CHEMBL1774
0.0250.0610.04Oxytocin agonist

0.04 0.031 CHEMBL3544571

CHEMBL3544571
0.0170.0540.669HCV NS5B polymerase inhibitor

0.05 0.01 CHEMBL917

0.09 0.005 CHEMBL54918

0.329 0.003 CHEMBL474163

0.18 0.004 CHEMBL886

0.601 0.002 CHEMBL590981

0.669 0.002 CHEMBL1774

CHEMBL1774
0.0410.0810.062Neutrophil collagenase inhibitor

0.062 0.048 CHEMBL3544571

CHEMBL3544571
0.040.0810.377Purinergic P2 antagonist

0.273 0.005 CHEMBL474163

0.237 0.005 CHEMBL886

0.344 0.004 CHEMBL590981

0.377 0.004 CHEMBL1774

CHEMBL1774
0.0230.0640.06Toll-Like receptor 2 agonist

0.035 0.034 CHEMBL54918

0.043 0.027 CHEMBL3544570

0.06 0.02 CHEMBL3544571

CHEMBL3544571
0.0180.060.033Calcitonin receptor agonist

0.033 0.024 CHEMBL3544571

CHEMBL3544571
0.0310.0730.043GABA B receptor antagonist

0.043 0.029 CHEMBL3544571

CHEMBL3544571
0.050.0920.16Aminopeptidase I inhibitor

0.118 0.02 CHEMBL3544570

0.16 0.011 CHEMBL3544571

CHEMBL3544571
0.0740.1170.111Glutamate release inhibitor

0.111 0.029 CHEMBL3544571

CHEMBL3544571
0.0040.0490.026Glutamate (mGluR6) agonist

0.011 0.009 CHEMBL3544570

0.026 0.003 CHEMBL3544571

CHEMBL3544571
0.0610.1070.367GABA B receptor agonist

0.138 0.005 CHEMBL3544570

0.367 0.002 CHEMBL3544571

CHEMBL3544571
0.1050.150.2Arachidonic acid antagonist

0.162 0.075 CHEMBL219497

0.154 0.084 CHEMBL3544570

0.2 0.033 CHEMBL3544571

CHEMBL3544571
0.0650.1110.099Prolactin inhibitor

0.091 0.065 CHEMBL3544570

0.099 0.057 CHEMBL3544571

CHEMBL3544571
0.0220.0690.054Vascular adhesion protein 1 inhibitor

0.043 0.022 CHEMBL219497

0.047 0.018 CHEMBL3544570

0.054 0.012 CHEMBL3544571

CHEMBL3544571
0.0270.0740.048AMPA 4 receptor antagonist

0.048 0.017 CHEMBL3544571

CHEMBL3544571
0.0130.0610.059Lysine carboxypeptidase inhibitor

0.038 0.011 CHEMBL3544570

0.059 0.006 CHEMBL3544571

CHEMBL3544571
0.0430.0920.13NMDA receptor agonist

0.13 0.011 CHEMBL3544570

0.125 0.012 CHEMBL3544571

CHEMBL3544570
0.0930.1430.189Interleukin 1 antagonist

0.189 0.038 CHEMBL917

CHEMBL917
0.1110.160.145Interferon gamma antagonist

0.126 0.12 CHEMBL917

0.14 0.092 CHEMBL54918

0.13 0.111 CHEMBL219497

0.145 0.084 CHEMBL3544571

CHEMBL3544571
0.0270.0770.073Mannosidase inhibitor

0.053 0.022 CHEMBL917

0.068 0.013 CHEMBL54918

0.043 0.035 CHEMBL3544570

0.073 0.01 CHEMBL3544571

CHEMBL3544571
0.0910.1420.177Protein kinase stimulant

0.177 0.051 CHEMBL54918

0.163 0.059 CHEMBL474163

0.12 0.093 CHEMBL3544571

CHEMBL54918
0.0250.0760.349Ribonucleotide reductase inhibitor

0.156 0.011 CHEMBL917

0.143 0.013 CHEMBL54918

0.229 0.006 CHEMBL474163

0.256 0.005 CHEMBL886

0.326 0.004 CHEMBL590981

0.071 0.031 CHEMBL3544570

0.062 0.035 CHEMBL3544571

0.349 0.004 CHEMBL1774

CHEMBL1774
0.1790.230.262Histamine release inhibitor

0.262 0.146 CHEMBL3544571

CHEMBL3544571
0.0090.0610.017Telomerase stimulant

0.017 0.011 CHEMBL3544571

CHEMBL3544571
0.0390.0920.18Carbonic anhydrase V inhibitor

0.087 0.032 CHEMBL917

0.109 0.024 CHEMBL54918

0.18 0.009 CHEMBL474163

0.161 0.012 CHEMBL886

0.074 0.04 CHEMBL590981

0.072 0.041 CHEMBL3544570

0.116 0.023 CHEMBL3544571

0.061 0.053 CHEMBL1774

CHEMBL474163
0.0680.120.091Granulocyte macrophage colony stimulating factor agonist

0.091 0.05 CHEMBL3544571

CHEMBL3544571
0.10.1550.697Hexokinase inhibitor

0.201 0.035 CHEMBL917

0.353 0.006 CHEMBL54918

0.575 0.003 CHEMBL474163

0.394 0.004 CHEMBL886

0.669 0.002 CHEMBL590981

0.697 0.002 CHEMBL1774

CHEMBL1774
0.0580.1140.096Interleukin-1 receptor-associated protein kinase 4 inhibitor

0.096 0.049 CHEMBL219497

CHEMBL219497
0.0220.080.051Glutamate (mGluR3) agonist

0.044 0.007 CHEMBL3544570

0.051 0.005 CHEMBL3544571

CHEMBL3544571
0.0110.0690.025AMPA 3 receptor antagonist

0.025 0.024 CHEMBL3544571

CHEMBL3544571
0.0230.0810.117Adenosine deaminase inhibitor

0.108 0.005 CHEMBL917

0.111 0.004 CHEMBL54918

0.103 0.005 CHEMBL474163

0.101 0.005 CHEMBL886

0.117 0.004 CHEMBL590981

0.047 0.033 CHEMBL3544571

0.109 0.004 CHEMBL1774

CHEMBL590981
0.0360.0960.131Antiviral (Hepatitis D)

0.062 0.02 CHEMBL474163

0.061 0.021 CHEMBL886

0.113 0.004 CHEMBL590981

0.131 0.004 CHEMBL1774

CHEMBL1774
0.0220.0820.032Melatonin receptor 1A agonist

0.032 0.026 CHEMBL3544570

CHEMBL3544570
0.0360.0960.259Adenosine A2 receptor antagonist

0.098 0.028 CHEMBL917

0.259 0.007 CHEMBL54918

CHEMBL54918
0.050.1120.261Ornithine decarboxylase inhibitor

0.141 0.014 CHEMBL3544570

0.261 0.004 CHEMBL3544571

CHEMBL3544571
0.0040.0660.013Lysophosphatidic acid receptor 3 agonist

0.013 0.01 CHEMBL3544571

CHEMBL3544571
0.0140.0760.03Lysophosphatidic acid receptor 1 agonist

0.03 0.011 CHEMBL3544571

CHEMBL3544571
0.0570.120.157Inducible nitric-oxide synthase inhibitor

0.125 0.023 CHEMBL3544570

0.157 0.015 CHEMBL3544571

CHEMBL3544571
0.0440.1080.064Protease 3C (Human rhinovirus) inhibitor

0.064 0.046 CHEMBL219497

CHEMBL219497
0.0210.0860.058Dopamine D5 agonist

0.058 0.013 CHEMBL3544571

CHEMBL3544571
0.0710.1360.227AMP-activated protein kinase stimulant

0.161 0.022 CHEMBL917

0.227 0.008 CHEMBL54918

0.164 0.02 CHEMBL474163

0.117 0.052 CHEMBL886

CHEMBL54918
0.0210.0870.028DNA topoisomerase IV inhibitor

0.028 0.026 CHEMBL219497

CHEMBL219497
0.0120.0790.035Isoleucine-tRNA ligase inhibitor

0.025 0.01 CHEMBL917

0.035 0.004 CHEMBL54918

CHEMBL54918
0.0220.0890.178Ribonucleoside-diphosphate reductase inhibitor

0.12 0.016 CHEMBL917

0.11 0.017 CHEMBL54918

0.164 0.009 CHEMBL474163

0.172 0.009 CHEMBL886

0.178 0.008 CHEMBL590981

0.069 0.029 CHEMBL3544570

0.057 0.036 CHEMBL3544571

0.165 0.009 CHEMBL1774

CHEMBL590981
0.0050.0750.017Aminopeptidase A inhibitor

0.017 0.013 CHEMBL3544571

CHEMBL3544571
0.0190.0930.664RNA-directed RNA polymerase inhibitor

0.051 0.012 CHEMBL917

0.075 0.007 CHEMBL54918

0.239 0.003 CHEMBL474163

0.146 0.004 CHEMBL886

0.583 0.002 CHEMBL590981

0.664 0.002 CHEMBL1774

CHEMBL1774
0.1750.2490.825DNA directed DNA polymerase inhibitor

0.502 0.081 CHEMBL917

0.36 0.133 CHEMBL54918

0.561 0.066 CHEMBL474163

0.686 0.037 CHEMBL886

0.778 0.023 CHEMBL590981

0.825 0.016 CHEMBL1774

CHEMBL1774
0.0380.1140.319Purinergic P2X1 antagonist

0.072 0.03 CHEMBL917

0.109 0.014 CHEMBL54918

0.249 0.002 CHEMBL474163

0.21 0.003 CHEMBL886

0.298 0.002 CHEMBL590981

0.061 0.042 CHEMBL3544571

0.319 0.001 CHEMBL1774

CHEMBL1774
0.0110.0910.02Neuraminidase (Influenza B) inhibitor

0.02 0.018 CHEMBL3544571

CHEMBL3544571
0.0380.1180.092DNA gyrase inhibitor

0.092 0.021 CHEMBL219497

0.066 0.041 CHEMBL3544570

CHEMBL219497
0.0850.1660.153Transcription factor STAT6 inhibitor

0.115 0.069 CHEMBL54918

0.153 0.021 CHEMBL474163

0.114 0.071 CHEMBL590981

0.102 0.1 CHEMBL1774

CHEMBL474163
0.0250.1080.069Acetylcholine muscarinic agonist

0.069 0.027 CHEMBL219497

CHEMBL219497
0.0190.1040.039Carboxypeptidase B inhibitor

0.038 0.015 CHEMBL3544570

0.039 0.014 CHEMBL3544571

CHEMBL3544571
0.0760.1620.166Toll-Like receptor 2 antagonist

0.129 0.069 CHEMBL3544570

0.166 0.042 CHEMBL3544571

CHEMBL3544571
0.0640.1510.089Estrogen-related receptor beta agonist

0.089 0.043 CHEMBL3544571

CHEMBL3544571
0.0160.1050.554Purinergic P2Y antagonist

0.092 0.01 CHEMBL917

0.117 0.007 CHEMBL54918

0.44 0.002 CHEMBL474163

0.409 0.002 CHEMBL886

0.523 0.001 CHEMBL590981

0.554 0.001 CHEMBL1774

CHEMBL1774
0.0760.1650.1Factor V inhibitor

0.1 0.069 CHEMBL3544570

0.1 0.069 CHEMBL3544571

CHEMBL3544571
0.0660.1550.426Mucolytic

0.14 0.038 CHEMBL917

0.214 0.011 CHEMBL54918

0.247 0.007 CHEMBL474163

0.165 0.025 CHEMBL886

0.385 0.003 CHEMBL590981

0.116 0.058 CHEMBL3544570

0.147 0.034 CHEMBL3544571

0.426 0.003 CHEMBL1774

CHEMBL1774
0.0160.1060.052Acetylcholine M1 receptor agonist

0.052 0.025 CHEMBL219497

CHEMBL219497
0.0250.1160.05Lysophosphatidic acid 3 receptor antagonist

0.05 0.036 CHEMBL3544571

CHEMBL3544571
0.0390.1310.185NAD(P)H dehydrogenase (quinone) inhibitor

0.14 0.022 CHEMBL474163

0.07 0.061 CHEMBL886

0.185 0.011 CHEMBL590981

0.166 0.015 CHEMBL1774

CHEMBL590981
0.0070.0990.09Arginase inhibitor

0.09 0.005 CHEMBL3544570

0.087 0.005 CHEMBL3544571

CHEMBL3544570
0.0440.1380.183GABA aminotransferase inhibitor

0.07 0.061 CHEMBL219497

0.112 0.02 CHEMBL3544570

0.183 0.005 CHEMBL3544571

CHEMBL3544571
0.0360.1320.078Protein kinase C beta inhibitor

0.078 0.033 CHEMBL917

0.067 0.053 CHEMBL54918

CHEMBL917
0.0470.1430.112Acetylcholine agonist

0.112 0.04 CHEMBL219497

CHEMBL219497
0.0150.1120.259Inosine monophosphate dehydrogenase inhibitor

0.048 0.016 CHEMBL54918

0.228 0.003 CHEMBL474163

0.065 0.009 CHEMBL886

0.259 0.003 CHEMBL590981

0.22 0.003 CHEMBL1774

CHEMBL590981
0.0750.1730.121Cathepsin H inhibitor

0.121 0.074 CHEMBL3544571

CHEMBL3544571
0.0130.110.025Vanilloid 2 agonist

0.025 0.019 CHEMBL3544571

CHEMBL3544571
0.0120.110.057Free fatty acid receptor 1 antagonist

0.057 0.006 CHEMBL3544571

CHEMBL3544571
0.0450.1450.218Adenosine A3 receptor antagonist

0.116 0.019 CHEMBL917

0.218 0.008 CHEMBL54918

CHEMBL54918
0.0350.1370.103Na+ K+ transporting ATPase inhibitor

0.103 0.029 CHEMBL3544571

CHEMBL3544571
0.0120.1150.082Sodium/glucose cotransporter inhibitor

0.043 0.006 CHEMBL917

0.082 0.003 CHEMBL54918

0.024 0.023 CHEMBL474163

CHEMBL54918
0.0560.160.08MAP kinase kinase 7 inhibitor

0.08 0.046 CHEMBL3544571

CHEMBL3544571
0.020.1250.236Adenosine A1 receptor antagonist

0.149 0.016 CHEMBL917

0.236 0.009 CHEMBL54918

0.057 0.042 CHEMBL474163

CHEMBL54918
0.0120.1180.035Diamine oxidase inhibitor

0.035 0.029 CHEMBL3544571

CHEMBL3544571
0.070.1770.14Photosensitizer

0.14 0.038 CHEMBL3544571

CHEMBL3544571
0.0170.1240.053Geranyltranstransferase inhibitor

0.053 0.019 CHEMBL590981

0.044 0.03 CHEMBL3544571

0.046 0.027 CHEMBL1774

CHEMBL590981
0.1470.2550.41Antithrombotic

0.192 0.188 CHEMBL917

0.256 0.121 CHEMBL54918

0.41 0.047 CHEMBL474163

0.321 0.076 CHEMBL886

0.352 0.064 CHEMBL590981

0.222 0.151 CHEMBL3544571

0.309 0.082 CHEMBL1774

CHEMBL474163
0.0160.1250.088Guanylate cyclase inhibitor

0.062 0.01 CHEMBL917

0.062 0.01 CHEMBL54918

0.081 0.003 CHEMBL474163

0.081 0.003 CHEMBL886

0.087 0.002 CHEMBL590981

0.04 0.033 CHEMBL3544571

0.088 0.002 CHEMBL1774

CHEMBL1774
0.0440.1550.072Interferon agonist

0.072 0.067 CHEMBL3544571

CHEMBL3544571
0.0350.1470.06I kappa B kinase 2 inhibitor

0.06 0.047 CHEMBL219497

CHEMBL219497
0.0170.1330.041Ceramide glucosyltransferase inhibitor

0.041 0.016 CHEMBL54918

0.037 0.023 CHEMBL590981

0.032 0.031 CHEMBL1774

CHEMBL54918
0.010.1270.041Prostaglandin F2 alpha agonist

0.041 0.005 CHEMBL3544571

CHEMBL3544571
0.0590.1760.264Amylase inhibitor

0.116 0.084 CHEMBL917

0.264 0.024 CHEMBL54918

0.153 0.062 CHEMBL219497

0.149 0.064 CHEMBL3544571

CHEMBL54918
0.0390.1580.099NMDA receptor antagonist

0.099 0.048 CHEMBL3544571

CHEMBL3544571
0.010.1310.464Phosphoglycerate kinase inhibitor

0.057 0.012 CHEMBL917

0.151 0.004 CHEMBL54918

0.371 0.002 CHEMBL474163

0.147 0.004 CHEMBL886

0.442 0.001 CHEMBL590981

0.04 0.02 CHEMBL3544570

0.04 0.019 CHEMBL3544571

0.464 0.001 CHEMBL1774

CHEMBL1774
0.0050.1310.123Inosine monophosphate dehydrogenase 2 inhibitor

0.106 0.003 CHEMBL474163

0.024 0.01 CHEMBL886

0.123 0.003 CHEMBL590981

0.104 0.003 CHEMBL1774

CHEMBL590981
0.0260.1540.069Sphingosine 1-phosphate receptor 3 antagonist

0.06 0.039 CHEMBL3544570

0.069 0.027 CHEMBL3544571

CHEMBL3544571
0.1050.2360.506Phospholipase C inhibitor

0.159 0.09 CHEMBL54918

0.506 0.006 CHEMBL474163

0.282 0.02 CHEMBL886

0.262 0.023 CHEMBL590981

0.191 0.05 CHEMBL3544570

0.215 0.036 CHEMBL3544571

0.229 0.03 CHEMBL1774

CHEMBL474163
0.0080.140.046Carbonic anhydrase IV inhibitor

0.046 0.028 CHEMBL3544571

CHEMBL3544571
0.0030.1360.031Adenosine A2a receptor agonist

0.031 0.005 CHEMBL54918

CHEMBL54918
0.0390.1740.089Histamine N-methyltransferase inhibitor

0.089 0.056 CHEMBL3544571

CHEMBL3544571
0.0950.2310.54Immunostimulant

0.403 0.049 CHEMBL917

0.42 0.044 CHEMBL54918

0.538 0.024 CHEMBL474163

0.519 0.027 CHEMBL886

0.54 0.024 CHEMBL590981

0.21 0.114 CHEMBL3544570

0.271 0.088 CHEMBL3544571

0.514 0.027 CHEMBL1774

CHEMBL590981
0.0170.1550.26Adenosine A2a receptor antagonist

0.112 0.022 CHEMBL917

0.26 0.007 CHEMBL54918

CHEMBL54918
0.0050.1440.031Adenosine A2 receptor agonist

0.015 0.014 CHEMBL917

0.031 0.005 CHEMBL54918

CHEMBL54918
0.0080.150.018Antibiotic Anthracycline-like

0.018 0.016 CHEMBL3544571

CHEMBL3544571
0.0330.1770.094Epoxide hydrolase inhibitor

0.094 0.029 CHEMBL3544570

CHEMBL3544570
0.0050.1510.162Adenosine kinase inhibitor

0.052 0.006 CHEMBL917

0.068 0.005 CHEMBL54918

0.098 0.003 CHEMBL474163

0.083 0.004 CHEMBL886

0.143 0.002 CHEMBL590981

0.162 0.002 CHEMBL1774

CHEMBL1774
0.020.1670.039Glutamate (mGluR group III) agonist

0.039 0.035 CHEMBL3544571

CHEMBL3544571
0.0070.1550.062Glucagon receptor antagonist

0.053 0.009 CHEMBL3544570

0.062 0.007 CHEMBL3544571

CHEMBL3544571
0.1240.2720.464Cholesterol antagonist

0.263 0.116 CHEMBL917

0.464 0.038 CHEMBL54918

0.195 0.169 CHEMBL474163

0.257 0.12 CHEMBL3544571

CHEMBL54918
0.0350.1840.109Adenine nucleotide translocase inhibitor

0.078 0.01 CHEMBL917

0.107 0.004 CHEMBL54918

0.109 0.004 CHEMBL474163

0.083 0.008 CHEMBL886

0.099 0.005 CHEMBL590981

0.096 0.005 CHEMBL1774

CHEMBL474163
0.0490.20.204GABA receptor agonist

0.204 0.017 CHEMBL3544571

CHEMBL3544571
0.0090.1610.02Retinoid X beta receptor antagonist

0.02 0.016 CHEMBL3544571

CHEMBL3544571
0.040.1920.085Carbonic anhydrase VI inhibitor

0.085 0.052 CHEMBL3544571

CHEMBL3544571
0.0580.210.107Microtubule formation inhibitor

0.107 0.078 CHEMBL3544570

CHEMBL3544570
0.0120.1680.043Carbonic anhydrase I stimulant

0.043 0.021 CHEMBL3544570

0.033 0.031 CHEMBL3544571

CHEMBL3544570
0.030.190.059Glucosylceramidase inhibitor

0.059 0.032 CHEMBL54918

0.051 0.045 CHEMBL219497

CHEMBL54918
0.0780.240.38NOS3 expression enhancer

0.38 0.009 CHEMBL917

0.268 0.023 CHEMBL54918

0.195 0.043 CHEMBL219497

0.161 0.063 CHEMBL886

CHEMBL917
0.0660.2310.242Acetylcholine M1 receptor antagonist

0.118 0.111 CHEMBL917

0.143 0.082 CHEMBL54918

0.154 0.07 CHEMBL474163

0.129 0.097 CHEMBL886

0.222 0.034 CHEMBL590981

0.242 0.027 CHEMBL1774

CHEMBL1774
0.040.2080.511Expectorant

0.113 0.056 CHEMBL917

0.207 0.019 CHEMBL54918

0.289 0.009 CHEMBL474163

0.169 0.029 CHEMBL886

0.477 0.004 CHEMBL590981

0.097 0.072 CHEMBL3544570

0.133 0.043 CHEMBL3544571

0.511 0.004 CHEMBL1774

CHEMBL1774
0.0220.1890.13-Oxoacyl-[acyl-carrier-protein] synthase inhibitor

0.087 0.021 CHEMBL474163

0.056 0.044 CHEMBL886

0.1 0.017 CHEMBL590981

0.085 0.022 CHEMBL1774

CHEMBL590981
0.0230.1910.076Sphingosine 1-phosphate receptor 4 agonist

0.076 0.04 CHEMBL3544571

CHEMBL3544571
0.0130.1810.041GABA uptake inhibitor

0.041 0.025 CHEMBL3544571

CHEMBL3544571
0.0270.1960.164Carbonic anhydrase XIII inhibitor

0.164 0.019 CHEMBL3544571

CHEMBL3544571
0.0370.2080.225Pim-1 kinase inhibitor

0.225 0.011 CHEMBL219497

CHEMBL219497
0.0510.2250.113Caspase 3 inhibitor

0.113 0.071 CHEMBL3544571

CHEMBL3544571
0.0060.1830.031Prostaglandin agonist

0.031 0.021 CHEMBL3544571

CHEMBL3544571
0.0470.2260.098Protein kinase C gamma inhibitor

0.098 0.081 CHEMBL917

CHEMBL917
0.0530.2370.115Carbonic anhydrase XV inhibitor

0.115 0.051 CHEMBL3544571

CHEMBL3544571
0.0480.2320.113Carbonic anhydrase III inhibitor

0.113 0.049 CHEMBL3544571

CHEMBL3544571
0.1190.3080.441Vasodilator, coronary

0.195 0.187 CHEMBL917

0.384 0.041 CHEMBL54918

0.296 0.091 CHEMBL474163

0.411 0.032 CHEMBL590981

0.441 0.025 CHEMBL1774

CHEMBL1774
0.0770.2680.184Vanilloid 1 agonist

0.155 0.034 CHEMBL3544570

0.184 0.017 CHEMBL3544571

CHEMBL3544571
0.0670.260.157Sphingosine 1-phosphate receptor 4 antagonist

0.13 0.056 CHEMBL3544570

0.157 0.028 CHEMBL3544571

CHEMBL3544571
0.0060.20.075Sodium/glucose cotransporter 2 inhibitor

0.037 0.009 CHEMBL917

0.075 0.004 CHEMBL54918

CHEMBL54918
0.0050.20.039Endothelial nitric-oxide synthase inhibitor

0.039 0.014 CHEMBL3544571

CHEMBL3544571
0.0510.2510.266Psychostimulant

0.266 0.053 CHEMBL474163

0.199 0.08 CHEMBL886

0.229 0.066 CHEMBL590981

0.183 0.09 CHEMBL1774

CHEMBL474163
0.0690.2710.382DNA methyltransferase I inhibitor

0.371 0.012 CHEMBL917

0.382 0.01 CHEMBL54918

CHEMBL54918
0.0090.210.036Retinoid X alpha receptor agonist

0.036 0.023 CHEMBL3544571

CHEMBL3544571
0.1130.3170.174Neuropeptide Y2 antagonist

0.174 0.173 CHEMBL3544570

CHEMBL3544570
0.0210.2280.063Check point kinase 1 inhibitor

0.063 0.053 CHEMBL219497

CHEMBL219497
0.1120.3210.68Vasodilator, peripheral

0.333 0.081 CHEMBL917

0.507 0.026 CHEMBL54918

0.446 0.042 CHEMBL474163

0.262 0.119 CHEMBL886

0.653 0.01 CHEMBL590981

0.196 0.18 CHEMBL3544570

0.325 0.085 CHEMBL3544571

0.68 0.008 CHEMBL1774

CHEMBL1774
0.0380.2530.142Nitric-oxide synthase inhibitor

0.101 0.059 CHEMBL3544570

0.142 0.026 CHEMBL3544571

CHEMBL3544571
0.0470.2630.213Transcription factor NF kappa B stimulant

0.12 0.025 CHEMBL917

0.16 0.014 CHEMBL54918

0.168 0.013 CHEMBL474163

0.132 0.021 CHEMBL886

0.213 0.008 CHEMBL590981

0.204 0.009 CHEMBL1774

CHEMBL590981
0.0030.2270.027Calcium-dependent phospholipase A2 inhibitor

0.014 0.007 CHEMBL3544570

0.027 0.004 CHEMBL3544571

CHEMBL3544571
0.0530.280.44Pyruvate kinase inhibitor

0.309 0.046 CHEMBL474163

0.398 0.021 CHEMBL590981

0.44 0.015 CHEMBL1774

CHEMBL1774
0.0680.2960.53DNA methylase inhibitor

0.525 0.005 CHEMBL917

0.53 0.005 CHEMBL54918

0.524 0.005 CHEMBL474163

0.52 0.005 CHEMBL886

0.448 0.008 CHEMBL590981

0.398 0.011 CHEMBL1774

CHEMBL54918
0.0540.2850.489TRKC antagonist

0.489 0.006 CHEMBL219497

CHEMBL219497
0.0240.2580.05Carbonic anhydrase II stimulant

0.05 0.04 CHEMBL3544570

0.048 0.045 CHEMBL3544571

CHEMBL3544570
0.050.2890.123Cyclooxygenase 3 inhibitor

0.123 0.074 CHEMBL3544571

CHEMBL3544571
0.0060.2540.019O6-alkylguanine-DNA alkyltransferase inhibitor

0.019 0.009 CHEMBL917

0.016 0.015 CHEMBL54918

CHEMBL917
0.0110.2770.056Carbonic anhydrase XIV inhibitor

0.056 0.027 CHEMBL3544571

CHEMBL3544571
0.0460.3250.209Phospholipase A2 inhibitor

0.146 0.078 CHEMBL3544570

0.209 0.038 CHEMBL3544571

CHEMBL3544571
0.0050.2930.297Purinergic P2Y12 antagonist

0.028 0.013 CHEMBL54918

0.114 0.004 CHEMBL474163

0.065 0.005 CHEMBL886

0.259 0.003 CHEMBL590981

0.297 0.003 CHEMBL1774

CHEMBL1774
0.0230.3170.072HIV-1 integrase inhibitor

0.072 0.046 CHEMBL886

CHEMBL886
0.0460.3530.1Hematopoietic

0.1 0.036 CHEMBL474163

0.097 0.039 CHEMBL886

0.079 0.076 CHEMBL590981

0.082 0.066 CHEMBL3544571

CHEMBL474163
0.0020.3130.036N-Acetylated alpha-linked acidic dipeptidase inhibitor

0.036 0.004 CHEMBL3544570

0.032 0.005 CHEMBL3544571

CHEMBL3544570
0.0450.3560.261Insulin sensitizer

0.228 0.049 CHEMBL3544570

0.261 0.029 CHEMBL3544571

CHEMBL3544571
0.0790.390.183Hypoxia-inducible factor 1 alpha inhibitor

0.183 0.174 CHEMBL54918

CHEMBL54918
0.1330.4620.222Ca2+/calmodulin-dependent kinase IV inhibitor

0.222 0.112 CHEMBL917

CHEMBL917
0.0440.380.18Spasmolytic

0.18 0.137 CHEMBL3544571

CHEMBL3544571
0.0340.3740.717DNA polymerase I inhibitor

0.507 0.004 CHEMBL917

0.445 0.005 CHEMBL54918

0.576 0.003 CHEMBL474163

0.201 0.028 CHEMBL219497

0.6 0.003 CHEMBL886

0.685 0.002 CHEMBL590981

0.125 0.064 CHEMBL3544571

0.717 0.001 CHEMBL1774

CHEMBL1774
0.1020.4690.38Interleukin 2 agonist

0.325 0.058 CHEMBL917

0.356 0.043 CHEMBL54918

0.243 0.127 CHEMBL3544570

0.38 0.034 CHEMBL3544571

CHEMBL3544571
0.0480.4180.402Interleukin 6 antagonist

0.402 0.007 CHEMBL917

0.205 0.038 CHEMBL54918

0.197 0.043 CHEMBL474163

0.367 0.009 CHEMBL886

0.134 0.116 CHEMBL590981

CHEMBL917
0.0220.410.075Somatostatin 1 agonist

0.072 0.062 CHEMBL3544570

0.075 0.058 CHEMBL3544571

CHEMBL3544571
0.0390.4290.156Neuropeptide Y1 antagonist

0.156 0.056 CHEMBL3544570

CHEMBL3544570
0.0040.410.047Dipeptidyl peptidase I inhibitor

0.047 0.009 CHEMBL219497

CHEMBL219497
0.0160.4410.331Topoisomerase I inhibitor

0.212 0.024 CHEMBL917

0.331 0.009 CHEMBL54918

0.187 0.03 CHEMBL474163

0.088 0.081 CHEMBL886

0.136 0.047 CHEMBL590981

0.121 0.055 CHEMBL1774

CHEMBL54918
0.0040.4360.034Epoxide hydrolase 2 inhibitor

0.034 0.012 CHEMBL3544570

CHEMBL3544570
0.0180.4540.137TRKB antagonist

0.137 0.055 CHEMBL219497

CHEMBL219497
0.0040.4510.337Kinesin-like protein 1 inhibitor

0.145 0.005 CHEMBL219497

0.082 0.01 CHEMBL3544570

0.337 0.003 CHEMBL3544571

CHEMBL3544571
0.0040.4510.337Kinesin antagonist

0.145 0.005 CHEMBL219497

0.082 0.01 CHEMBL3544570

0.337 0.003 CHEMBL3544571

CHEMBL3544571
0.0320.4850.141MAP3K9 inhibitor

0.141 0.074 CHEMBL917

CHEMBL917
0.0130.4710.052Glutamate (mGluR8) antagonist

0.037 0.021 CHEMBL3544570

0.052 0.008 CHEMBL3544571

CHEMBL3544571
0.0050.4810.088NMDA 2B receptor antagonist

0.088 0.018 CHEMBL219497

CHEMBL219497
0.0050.4880.051Purinergic P2X3 antagonist

0.041 0.016 CHEMBL590981

0.051 0.011 CHEMBL1774

CHEMBL1774
0.0680.5670.333Apoptosis antagonist

0.224 0.153 CHEMBL917

0.333 0.065 CHEMBL54918

0.271 0.108 CHEMBL474163

0.236 0.142 CHEMBL3544571

CHEMBL54918
0.0050.5140.109HIV-1 integrase (Strand Transfer) inhibitor

0.079 0.031 CHEMBL474163

0.109 0.019 CHEMBL886

CHEMBL886
0.0640.5850.566Cyclophilin D inhibitor

0.371 0.108 CHEMBL54918

0.409 0.086 CHEMBL3544570

0.566 0.034 CHEMBL3544571

CHEMBL3544571
0.0030.5240.328Purinergic P2X agonist

0.028 0.018 CHEMBL917

0.049 0.01 CHEMBL54918

0.143 0.002 CHEMBL474163

0.108 0.003 CHEMBL886

0.268 0.001 CHEMBL590981

0.328 0.001 CHEMBL1774

CHEMBL1774
0.010.5390.044Toll-Like receptor 4 agonist

0.044 0.004 CHEMBL474163

0.041 0.005 CHEMBL886

0.036 0.006 CHEMBL590981

0.035 0.007 CHEMBL1774

CHEMBL474163
0.0030.5610.034Dipeptidyl peptidase IX inhibitor

0.034 0.005 CHEMBL219497

CHEMBL219497
0.0030.5620.019Dipeptidyl peptidase VIII inhibitor

0.019 0.007 CHEMBL219497

CHEMBL219497
0.0040.5780.161Integrin beta6 antagonist

0.161 0.001 CHEMBL219497

0.015 0.008 CHEMBL3544571

CHEMBL219497
0.0210.620.108Nav1.4 sodium channel blocker

0.092 0.09 CHEMBL3544570

0.108 0.064 CHEMBL3544571

CHEMBL3544571
0.0540.6670.848Antiinflammatory

0.848 0.009 CHEMBL219497

CHEMBL219497
0.0030.6260.104Purinergic P2Y1 antagonist

0.085 0.003 CHEMBL474163

0.089 0.003 CHEMBL886

0.093 0.003 CHEMBL590981

0.104 0.003 CHEMBL1774

CHEMBL1774
0.0070.6360.138Toll-Like receptor 7 antagonist

0.138 0.008 CHEMBL219497

CHEMBL219497
0.0230.6580.486Tumour necrosis factor alpha release inhibitor

0.486 0.015 CHEMBL219497

CHEMBL219497
0.0130.6550.069CXC chemokine 1 receptor antagonist

0.062 0.02 CHEMBL3544570

0.069 0.014 CHEMBL3544571

CHEMBL3544571
0.0040.6470.05Integrin alphaVbeta3 antagonist

0.05 0.005 CHEMBL219497

CHEMBL219497
0.0050.6580.036Growth factor receptor-bound protein 2 antagonist

0.036 0.022 CHEMBL474163

0.035 0.023 CHEMBL886

0.034 0.028 CHEMBL590981

0.033 0.029 CHEMBL1774

CHEMBL474163
0.0030.6790.387Purinergic P2T antagonist

0.037 0.011 CHEMBL54918

0.119 0.004 CHEMBL474163

0.081 0.006 CHEMBL886

0.342 0.003 CHEMBL590981

0.387 0.003 CHEMBL1774

CHEMBL1774
0.0040.6850.105HIV-1 integrase (3'-Processing) inhibitor

0.071 0.038 CHEMBL474163

0.105 0.024 CHEMBL886

CHEMBL886
0.030.7170.598Immunomodulator

0.307 0.079 CHEMBL917

0.395 0.045 CHEMBL54918

0.428 0.036 CHEMBL474163

0.598 0.012 CHEMBL219497

0.351 0.059 CHEMBL886

0.486 0.025 CHEMBL590981

0.288 0.089 CHEMBL3544570

0.547 0.017 CHEMBL3544571

0.456 0.03 CHEMBL1774

CHEMBL219497
0.0140.7070.328Vasodilator

0.212 0.095 CHEMBL54918

0.248 0.07 CHEMBL474163

0.155 0.15 CHEMBL886

0.306 0.046 CHEMBL590981

0.328 0.04 CHEMBL1774

CHEMBL1774
0.0070.7040.037Erythropoietin receptor agonist

0.037 0.032 CHEMBL3544570

CHEMBL3544570
0.0280.7250.202Hepatoprotectant

0.171 0.088 CHEMBL917

0.202 0.063 CHEMBL54918

0.146 0.114 CHEMBL474163

0.148 0.112 CHEMBL590981

0.153 0.107 CHEMBL1774

CHEMBL54918
0.0090.7160.104Uric acid excretion stimulant

0.104 0.049 CHEMBL54918

CHEMBL54918
0.0090.7220.324Platelet antagonist

0.159 0.135 CHEMBL54918

0.237 0.078 CHEMBL474163

0.185 0.113 CHEMBL886

0.31 0.049 CHEMBL590981

0.169 0.126 CHEMBL3544570

0.278 0.061 CHEMBL3544571

0.324 0.045 CHEMBL1774

CHEMBL1774
0.0120.7340.226Angiogenesis stimulant

0.151 0.122 CHEMBL917

0.226 0.081 CHEMBL54918

0.17 0.11 CHEMBL474163

0.176 0.107 CHEMBL3544571

CHEMBL54918
0.0030.7270.055Complement C3a chemotactic receptor antagonist

0.055 0.024 CHEMBL3544570

0.049 0.027 CHEMBL3544571

CHEMBL3544570
0.0050.7320.037Acetyl-CoA carboxylase inhibitor

0.037 0.036 CHEMBL3544570

CHEMBL3544570
0.0080.7390.168Antibiotic Aminoglycoside-like

0.055 0.011 CHEMBL917

0.053 0.011 CHEMBL54918

0.042 0.019 CHEMBL474163

0.033 0.031 CHEMBL219497

0.043 0.018 CHEMBL886

0.039 0.022 CHEMBL590981

0.067 0.006 CHEMBL3544570

0.168 0.001 CHEMBL3544571

0.038 0.023 CHEMBL1774

CHEMBL3544571
0.0030.7390.024S-adenosyl-L-homocysteine hydrolase inhibitor

0.018 0.008 CHEMBL917

0.024 0.005 CHEMBL54918

0.016 0.009 CHEMBL474163

0.015 0.011 CHEMBL590981

0.014 0.011 CHEMBL1774

CHEMBL54918
0.0090.7490.083Autotaxin inhibitor

0.083 0.017 CHEMBL474163

0.064 0.025 CHEMBL886

CHEMBL474163
0.0080.7510.138Protein kinase C mu inhibitor

0.138 0.031 CHEMBL917

CHEMBL917
0.0130.7610.22Insulin secretagoues

0.117 0.116 CHEMBL54918

0.15 0.074 CHEMBL474163

0.206 0.033 CHEMBL590981

0.22 0.027 CHEMBL1774

CHEMBL1774
0.010.7670.079Calcium-independent phospholipase A2 inhibitor

0.063 0.003 CHEMBL3544570

0.079 0.002 CHEMBL3544571

CHEMBL3544571
0.0290.7870.09Folate antagonist

0.09 0.088 CHEMBL3544571

CHEMBL3544571
0.0050.7770.093Protein kinase C eta inhibitor

0.093 0.019 CHEMBL917

CHEMBL917
00.7750.016Mannitol 2-dehydrogenase inhibitor

0.016 0.003 CHEMBL474163

0.015 0.003 CHEMBL886

0.009 0.005 CHEMBL590981

0.009 0.005 CHEMBL1774

CHEMBL474163
0.0030.7810.118Protein 30S ribosomal subunit inhibitor

0.026 0.015 CHEMBL3544570

0.118 0.002 CHEMBL3544571

CHEMBL3544571
0.0080.8070.139Prostaglandin F2 alpha antagonist

0.127 0.005 CHEMBL3544570

0.139 0.005 CHEMBL3544571

CHEMBL3544571
0.0080.8110.1645 Hydroxytryptamine 1B agonist

0.063 0.023 CHEMBL3544570

0.164 0.004 CHEMBL3544571

CHEMBL3544571
0.0050.8170.11Phenylethanolamine N methyltransferase inhibitor

0.11 0.003 CHEMBL219497

CHEMBL219497
0.0030.820.038Adenosine A3 receptor agonist

0.019 0.01 CHEMBL917

0.038 0.004 CHEMBL54918

0.022 0.008 CHEMBL474163

0.02 0.009 CHEMBL590981

0.019 0.009 CHEMBL1774

CHEMBL54918
0.0060.8340.073Protein 50S ribosomal subunit inhibitor

0.052 0.038 CHEMBL917

0.073 0.023 CHEMBL54918

0.07 0.024 CHEMBL474163

0.052 0.038 CHEMBL886

0.063 0.029 CHEMBL590981

0.061 0.03 CHEMBL1774

CHEMBL54918
0.0020.830.047Free fatty acid receptor 1 agonist

0.047 0.005 CHEMBL3544571

CHEMBL3544571
0.0020.8420.127Inosine monophosphate dehydrogenase 1 inhibitor

0.034 0.007 CHEMBL54918

0.096 0.003 CHEMBL474163

0.057 0.004 CHEMBL886

0.127 0.002 CHEMBL590981

0.118 0.002 CHEMBL1774

CHEMBL590981
0.0020.8610.042HMG CoA reductase inhibitor

0.042 0.013 CHEMBL3544571

CHEMBL3544571
0.0020.8670.052Prostacyclin agonist

0.021 0.008 CHEMBL3544570

0.052 0.004 CHEMBL3544571

CHEMBL3544571
0.0050.8780.593Aminoacyl-tRNA synthetase inhibitor

0.151 0.019 CHEMBL917

0.27 0.007 CHEMBL54918

0.402 0.004 CHEMBL474163

0.349 0.005 CHEMBL886

0.538 0.003 CHEMBL590981

0.593 0.003 CHEMBL1774

CHEMBL1774
0.0160.8910.074Lipocortins synthesis agonist

0.074 0.017 CHEMBL219497

0.06 0.035 CHEMBL3544571

CHEMBL219497
0.0040.8880.037Integrin alpha5beta1 antagonist

0.037 0.035 CHEMBL3544570

CHEMBL3544570
0.0060.9010.282Purinergic P2X2 antagonist

0.217 0.004 CHEMBL474163

0.192 0.005 CHEMBL886

0.262 0.003 CHEMBL590981

0.282 0.002 CHEMBL1774

CHEMBL1774
0.0030.9050.085Selectin antagonist

0.085 0.034 CHEMBL54918

0.078 0.038 CHEMBL3544571

CHEMBL54918
0.0290.9330.142Sphingosine 1-phosphate receptor 2 agonist

0.142 0.031 CHEMBL474163

0.142 0.031 CHEMBL886

CHEMBL886
0.0110.9320.133Toll-Like receptor 4 antagonist

0.133 0.033 CHEMBL474163

0.118 0.046 CHEMBL886

0.115 0.049 CHEMBL590981

0.109 0.057 CHEMBL1774

CHEMBL474163
0.020.9410.223Sodium/bile acid cotransporter inhibitor

0.223 0.158 CHEMBL3544571

CHEMBL3544571
0.010.9370.057DNA helicase inhibitor

0.057 0.033 CHEMBL3544571

CHEMBL3544571
0.0040.9310.059Neuraminidase (influenza) inhibitor

0.059 0.055 CHEMBL3544571

CHEMBL3544571
0.0050.9360.644Chelator

0.251 0.016 CHEMBL3544570

0.644 0.003 CHEMBL3544571

CHEMBL3544571
0.0020.9360.027Adenosine A2b receptor agonist

0.015 0.009 CHEMBL917

0.027 0.004 CHEMBL54918

0.018 0.007 CHEMBL474163

0.016 0.008 CHEMBL590981

0.016 0.008 CHEMBL1774

CHEMBL54918
0.0040.950.044VCAM-1 antagonist

0.044 0.015 CHEMBL3544570

0.043 0.017 CHEMBL3544571

CHEMBL3544570
0.0040.950.044VCAM antagonist

0.044 0.015 CHEMBL3544570

0.043 0.017 CHEMBL3544571

CHEMBL3544570
0.0040.9570.179Hypolipemic

0.179 0.11 CHEMBL3544570

CHEMBL3544570
0.0070.9640.17Vanilloid agonist

0.105 0.028 CHEMBL3544570

0.17 0.009 CHEMBL3544571

CHEMBL3544571
0.0020.9690.098Adenosine A1 receptor agonist

0.044 0.007 CHEMBL917

0.098 0.004 CHEMBL54918

0.069 0.004 CHEMBL474163

0.038 0.008 CHEMBL886

0.053 0.005 CHEMBL590981

0.05 0.006 CHEMBL1774

CHEMBL54918
0.0040.980.175Thrombolytic

0.175 0.065 CHEMBL3544571

CHEMBL3544571
0.0050.9820.191Platelet adhesion inhibitor

0.189 0.077 CHEMBL54918

0.189 0.077 CHEMBL474163

0.191 0.076 CHEMBL590981

0.164 0.093 CHEMBL1774

CHEMBL590981
0.0030.9820.064Leukotriene synthesis inhibitor

0.064 0.049 CHEMBL3544570

CHEMBL3544570
0.0020.9830.07Sphingosine 1-phosphate receptor 3 agonist

0.07 0.01 CHEMBL474163

0.067 0.01 CHEMBL886

CHEMBL474163
0.0090.9910.206Caspase 3 stimulant

0.206 0.16 CHEMBL54918

CHEMBL54918
0.0040.9870.192Hypoglycemic

0.177 0.137 CHEMBL54918

0.163 0.158 CHEMBL3544570

0.192 0.12 CHEMBL3544571

CHEMBL3544571
0.0030.9860.054Sphingosine 1-phosphate receptor 5 agonist

0.054 0.037 CHEMBL474163

0.054 0.036 CHEMBL886

CHEMBL886
0.0040.990.131Nitric oxide antagonist

0.131 0.117 CHEMBL54918

CHEMBL54918
0.0040.9910.111Bone formation stimulant

0.111 0.094 CHEMBL474163

CHEMBL474163
Ext Pa Pi Pmax Activity Other Results ID Pa_max