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

Ext Pa Pi Pmax Activity Other Results ID Pa_max
0.8170.0030.817Alcohol oxidase inhibitor

0.594 0.003 CID_999

0.7530.0050.753Aldehyde oxidase inhibitor

0.668 0.011 CID_999

0.7240.0020.724Tyrosine 3 hydroxylase inhibitor

0.598 0.003 CID_999

0.7010.0020.701Glutamate decarboxylase inhibitor

0.532 0.002 CID_999

0.6750.0170.719Cyclophilin D inhibitor

0.719 0.012 CID_999

CID_999
0.6820.0260.682Caspase 9 stimulant

0.577 0.04 CID_999

0.6530.0020.715GABA C receptor agonist

0.715 0.002 CID_999

CID_999
0.6440.0030.834Prostaglandin antagonist

0.834 0.003 CID_999

CID_999
0.630.0040.63Peroxidase inhibitor

0.525 0.008 CID_999

0.6270.0080.627Histamine release inhibitor

0.589 0.011 CID_999

0.6180.0130.6185 Hydroxytryptamine release stimulant

0.612 0.013 CID_999

0.6050.010.6055 Hydroxytryptamine release inhibitor

0.597 0.011 CID_999

0.5960.0040.706Alpha-N-acetylglucosaminidase inhibitor

0.706 0.003 CID_999

CID_999
0.6070.0180.607Cholesterol antagonist

0.571 0.022 CID_999

0.560.0090.56Superoxide dismutase inhibitor

0.504 0.013 CID_999

0.5520.0030.552Porphobilinogen synthase inhibitor

0.512 0.003 CID_999

0.5520.0050.554Anesthetic general

0.554 0.005 CID_999

CID_999
0.5460.0020.546Histidine decarboxylase inhibitor

0.468 0.003 CID_999

0.5950.0550.595Antiinflammatory

0.578 0.06 CID_999

0.540.0030.801Prostaglandin D2 antagonist

0.801 0.002 CID_999

CID_999
0.5450.0150.545GABA C receptor rho-3 antagonist

0.51 0.023 CID_999

0.5460.0240.633Toll-Like receptor 7 agonist

0.633 0.014 CID_999

CID_999
0.540.0250.63Toll-Like receptor agonist

0.63 0.014 CID_999

CID_999
0.5240.020.524Calcium channel L-type activator

0.501 0.027 CID_999

0.5090.0040.5145 Hydroxytryptamine uptake stimulant

0.514 0.004 CID_999

CID_999
0.5240.0260.524Antithrombotic

0.524 0.026 CID_999

0.5080.0130.605Platelet antagonist

0.605 0.006 CID_999

CID_999
0.5080.0140.508Hypoglycemic

0.477 0.017 CID_999

0.50.0080.521Interleukin 2 agonist

0.521 0.006 CID_999

CID_999
0.4940.0020.494Phenylalanine 4-hydroxylase inhibitor

0.404 0.003 CID_999

0.4910.0040.491Cystathionine beta-synthase inhibitor

0.346 0.007 CID_999

0.5070.0430.507Transcription factor NF kappa B inhibitor

0.412 0.061 CID_999

0.4560.0070.456Sodium/bile acid cotransporter inhibitor

0.453 0.007 CID_999

0.4530.0130.476Interleukin agonist

0.476 0.01 CID_999

CID_999
0.4430.0090.443Non-steroidal antiinflammatory agent

0.439 0.01 CID_999

0.4520.0240.452Interleukin antagonist

0.404 0.03 CID_999

0.4380.0230.438Free radical scavenger

0.24 0.073 CID_999

0.4240.0170.434Calcium channel activator

0.434 0.014 CID_999

CID_999
0.4240.0210.465Hypolipemic

0.465 0.016 CID_999

CID_999
0.4310.030.431Antioxidant

0.252 0.082 CID_999

0.440.0430.449Vasodilator, peripheral

0.449 0.041 CID_999

CID_999
0.4050.0090.405Amylase inhibitor

0.32 0.016 CID_999

0.3920.0020.392DOPA decarboxylase inhibitor

0.316 0.002 CID_999

0.3980.010.398Phospholipase C inhibitor

0.343 0.015 CID_999

0.3860.0040.4Succinate dehydrogenase inhibitor

0.4 0.004 CID_999

CID_999
0.4080.0350.408Lipoxygenase inhibitor

0.309 0.067 CID_999

0.3780.0080.378Insulin sensitizer

0.362 0.008 CID_999

0.3920.0230.392Insulysin inhibitor

0.387 0.024 CID_999

0.3650.0040.49Ferrochelatase inhibitor

0.49 0.003 CID_999

CID_999
0.3670.0070.451Insulin secretagoues

0.451 0.005 CID_999

CID_999
0.3580.0050.358Cyclooxygenase 3 inhibitor

0.311 0.005 CID_999

0.3570.0080.357Neurotrophic factor enhancer

0.303 0.017 CID_999

0.3520.0030.352Creatine kinase inhibitor

0.244 0.006 CID_999

0.3470.0050.419UDP-N-acetylglucosamine 1-carboxyvinyltransferase inhibitor

0.419 0.004 CID_999

CID_999
0.3470.0110.396Gastrin inhibitor

0.396 0.005 CID_999

CID_999
0.3940.0580.394Thyroid hormone antagonist

0.374 0.065 CID_999

0.3420.0080.342Cholesterol synthesis inhibitor

0.314 0.01 CID_999

0.3440.010.344Cyclooxygenase 1 inhibitor

0.333 0.011 CID_999

0.3380.0140.338Glyceraldehyde-3-phosphate dehydrogenase inhibitor

0.305 0.022 CID_999

0.3270.0040.393Triose-phosphate isomerase inhibitor

0.393 0.003 CID_999

CID_999
0.3490.0260.349Cyclic AMP phosphodiesterase inhibitor

0.341 0.028 CID_999

0.3270.0050.37Adenylate kinase inhibitor

0.37 0.004 CID_999

CID_999
0.3230.0070.323Interleukin 4 antagonist

0.241 0.014 CID_999

0.3290.0150.329Monophenol monooxygenase inhibitor

0.203 0.032 CID_999

0.3250.0170.325Interferon gamma antagonist

0.285 0.022 CID_999

0.3260.0190.326Melanin inhibitor

0.21 0.037 CID_999

0.3160.010.316Aldehyde dehydrogenase inhibitor

0.252 0.018 CID_999

0.310.0050.31Alcohol dehydrogenase inhibitor

0.236 0.009 CID_999

0.3860.0810.38615-Lipoxygenase inhibitor

0.291 0.138 CID_999

0.3160.0110.316Phospholipase A2 inhibitor

0.3 0.014 CID_999

0.3530.0550.353Apoptosis antagonist

0.32 0.073 CID_999

0.3230.0280.323Growth hormone agonist

0.321 0.028 CID_999

0.2990.0040.299Aldose reductase inhibitor

0.298 0.004 CID_999

0.2950.0050.385Peroxisome proliferator-activated receptor gamma agonist

0.385 0.004 CID_999

CID_999
0.3520.0640.352Immunostimulant

0.329 0.071 CID_999

0.2990.0120.299Nitric-oxide synthase stimulant

0.277 0.018 CID_999

0.3450.0590.34512-Lipoxygenase inhibitor

0.259 0.104 CID_999

0.3140.0290.314Platelet adhesion inhibitor

0.314 0.03 CID_999

0.290.0070.29NMDA receptor antagonist

0.216 0.012 CID_999

0.2870.0050.287Potassium channel (Ca-activated) activator

0.233 0.009 CID_999

0.2860.0060.286Catenin beta inhibitor

0.271 0.008 CID_999

0.2970.0180.31Cyclooxygenase inhibitor

0.31 0.016 CID_999

CID_999
0.3380.0610.338Vasodilator, coronary

0.335 0.063 CID_999

0.3140.0390.314DNA synthesis inhibitor

0.306 0.041 CID_999

0.3140.0390.338Psychostimulant

0.338 0.034 CID_999

CID_999
0.30.0280.3DNA methylase inhibitor

0.279 0.035 CID_999

0.3430.0710.343Thyroid hormone beta antagonist

0.326 0.077 CID_999

0.2750.0050.306GABA C receptor antagonist

0.306 0.004 CID_999

CID_999
0.2790.010.279Expectorant

0.249 0.013 CID_999

0.2730.0050.273Interleukin 8 antagonist

0.267 0.005 CID_999

0.2790.0110.286UDP-glucose 4-epimerase inhibitor

0.286 0.011 CID_999

CID_999
0.2950.0280.295DNA methyltransferase I inhibitor

0.272 0.037 CID_999

0.2740.0070.318Catalase inhibitor

0.318 0.005 CID_999

CID_999
0.2720.0050.272Mucolytic

0.253 0.006 CID_999

0.2730.0070.273Carbonic anhydrase III inhibitor

0.2 0.016 CID_999

0.2940.030.294Dual specificity phosphatase 3 inhibitor

0.257 0.038 CID_999

0.3250.0610.325Spasmolytic

0.311 0.066 CID_999

0.2680.0040.268NMDA receptor subunit 3B antagonist

0.206 0.004 CID_999

0.3490.0870.359Immunosuppressant

0.359 0.082 CID_999

CID_999
0.2830.0220.283Protein-tyrosine phosphatase inhibitor

0.264 0.027 CID_999

0.2730.0120.398Cell adhesion inhibitor

0.398 0.005 CID_999

CID_999
0.2630.0040.269HIV-1 integrase (Overall Integration) inhibitor

0.269 0.004 CID_999

CID_999
0.3050.0470.305Angiogenesis stimulant

0.262 0.065 CID_999

0.2620.0050.338ABCA1 expression enhancer

0.338 0.005 CID_999

CID_999
0.260.0040.26Arachidonic acid antagonist

0.257 0.004 CID_999

0.2570.0050.257Keratolytic

0.187 0.009 CID_999

0.270.0210.27Bone formation stimulant

0.242 0.026 CID_999

0.2520.0060.256Photosensitizer

0.256 0.005 CID_999

CID_999
0.2650.0190.265Neurotensin receptor agonist

0.235 0.024 CID_999

0.250.0050.334Prostaglandin EP2 antagonist

0.334 0.004 CID_999

CID_999
0.2530.0070.263Phosphofructokinase-1 inhibitor

0.263 0.007 CID_999

CID_999
0.2470.0040.312Peroxisome proliferator-activated receptor delta antagonist

0.312 0.003 CID_999

CID_999
0.3060.0630.306Hypoxia-inducible factor 1 alpha inhibitor

0.246 0.105 CID_999

0.2460.0040.246GABA aminotransferase inhibitor

0.208 0.004 CID_999

0.2730.0330.273Dual specificity phosphatase inhibitor

0.227 0.044 CID_999

0.2520.0130.252ATPase inhibitor

0.25 0.014 CID_999

0.2620.0240.262Protein kinase stimulant

0.222 0.034 CID_999

0.2420.0040.242NMDA receptor subunit 3A antagonist

0.183 0.004 CID_999

0.2510.0150.2515-Lipoxygenase inhibitor

0.183 0.028 CID_999

0.2430.0090.243Estrogen antagonist
0.2390.0050.273GABA C receptor rho-1 antagonist

0.273 0.004 CID_999

CID_999
0.2470.0130.265Aminopeptidase B inhibitor

0.265 0.011 CID_999

CID_999
0.2330.0030.233GABA B receptor agonist

0.188 0.004 CID_999

0.240.0110.24Toll-Like receptor 2 antagonist

0.208 0.02 CID_999

0.250.0210.25NADPH oxidase inhibitor

0.195 0.036 CID_999

0.2330.0050.233Adenylate cyclase stimulant

0.216 0.008 CID_999

0.2310.0030.264Thyroid hormone alpha antagonist

0.264 0.002 CID_999

CID_999
0.2320.0070.232Vanilloid 1 agonist

0.209 0.01 CID_999

0.2340.010.234Carbonic anhydrase VI inhibitor

0.164 0.018 CID_999

0.2260.0050.236Sphingosine 1-phosphate receptor 5 antagonist

0.236 0.004 CID_999

CID_999
0.2340.0150.24GABA C receptor rho-2 antagonist

0.24 0.014 CID_999

CID_999
0.2250.0070.225TRPA1 agonist

0.2 0.01 CID_999

0.2230.0060.223Prolactin inhibitor

0.195 0.009 CID_999

0.2450.0280.245Lipid peroxidase inhibitor

0.127 0.087 CID_999

0.260.0440.26RNA-directed DNA polymerase inhibitor

0.255 0.046 CID_999

0.230.0150.23Farnesoid X receptor antagonist

0.176 0.031 CID_999

0.2230.0090.228NADH dehydrogenase inhibitor

0.228 0.009 CID_999

CID_999
0.2180.0050.218Potassium channel large-conductance Ca-activated activator

0.185 0.007 CID_999

0.2570.0460.257Peptidyltransferase inhibitor

0.243 0.056 CID_999

0.220.0090.268Glutamate dehydrogenase inhibitor

0.268 0.006 CID_999

CID_999
0.2370.0260.239Interleukin 6 antagonist

0.239 0.025 CID_999

CID_999
0.2110.0040.211Bile acid receptor antagonist

0.177 0.005 CID_999

0.2210.0140.23Cathepsin G inhibitor

0.23 0.014 CID_999

CID_999
0.220.0160.22Carbonic anhydrase XV inhibitor

0.166 0.026 CID_999

0.3230.1190.323Antibacterial

0.282 0.149 CID_999

0.2120.0090.212Estrogen receptor beta antagonist
0.2060.0040.228Sphingosine 1-phosphate receptor 4 agonist

0.228 0.004 CID_999

CID_999
0.310.110.416Antiobesity

0.416 0.06 CID_999

CID_999
0.2230.0230.223Protein-tyrosine phosphatase 1B inhibitor

0.2 0.029 CID_999

0.2050.0050.282Biliverdin reductase inhibitor

0.282 0.004 CID_999

CID_999
0.2060.0070.206Macrophage migration inhibitory factor inhibitor

0.124 0.024 CID_999

0.2430.0450.243Hepatoprotectant

0.204 0.063 CID_999

0.2090.0120.209Uric acid excretion stimulant

0.189 0.014 CID_999

0.2330.0380.249Thrombolytic

0.249 0.034 CID_999

CID_999
0.2530.060.253Pyruvate kinase inhibitor

0.18 0.093 CID_999

0.2130.0220.213Chelator

0.115 0.059 CID_999

0.1980.0080.204Sphingosine 1-phosphate receptor 2 antagonist

0.204 0.007 CID_999

CID_999
0.1950.0070.222Aminopeptidase I inhibitor

0.222 0.005 CID_999

CID_999
0.2410.0560.361Platelet aggregation inhibitor

0.361 0.024 CID_999

CID_999
0.1920.0080.192Carbonic anhydrase V inhibitor

0.171 0.01 CID_999

0.1980.0140.198Carbonic anhydrase XIII inhibitor

0.136 0.025 CID_999

0.2080.0240.208Adenylate cyclase inhibitor

0.191 0.027 CID_999

0.2380.0550.238Nitric oxide antagonist

0.161 0.087 CID_999

0.1850.0030.185Estrogen-related receptor beta agonist

0.146 0.004 CID_999

0.1830.0050.189Ca2+-transporting ATPase inhibitor

0.189 0.005 CID_999

CID_999
0.1820.0050.238NMDA receptor agonist

0.238 0.004 CID_999

CID_999
0.2150.0390.269Diuretic

0.269 0.028 CID_999

CID_999
0.180.0040.292Aconitate hydratase inhibitor

0.292 0.002 CID_999

CID_999
0.1880.0120.216Sphingosine 1-phosphate receptor 4 antagonist

0.216 0.007 CID_999

CID_999
0.1870.0130.187AMP-activated protein kinase stimulant

0.164 0.02 CID_999

0.2190.0450.255Lipocortins synthesis antagonist

0.255 0.032 CID_999

CID_999
0.1820.0090.231Argininosuccinate synthase inhibitor

0.231 0.006 CID_999

CID_999
0.1810.0110.242Electrolyte absorption antagonist

0.242 0.005 CID_999

CID_999
0.1810.0120.181Heat shock protein 70 antagonist

0.169 0.018 CID_999

0.1760.0070.176Leukotriene antagonist

0.162 0.009 CID_999

0.2020.0340.202Hexokinase inhibitor

0.196 0.038 CID_999

0.1990.0310.213Mannose-6-phosphate isomerase inhibitor

0.213 0.024 CID_999

CID_999
0.2660.0990.266Caspase 3 stimulant
0.2420.0750.242Antiamyloidogenic

0.177 0.117 CID_999

0.2050.0390.205NOS3 expression enhancer

0.122 0.112 CID_999

0.1980.0310.21Cyclooxygenase 2 inhibitor

0.21 0.028 CID_999

CID_999
0.1840.0180.184Mediator release inhibitor

0.157 0.026 CID_999

0.1730.0070.173Carbonic anhydrase VA inhibitor

0.157 0.009 CID_999

0.1880.0220.188Xanthine oxidase inhibitor

0.125 0.045 CID_999

0.1920.0270.192CF transmembrane conductance regulator agonist

0.166 0.052 CID_999

0.3330.1710.434Ca2+/calmodulin-dependent protein kinase kinase A inhibitor

0.434 0.073 CID_999

CID_999
0.1920.0310.192DNA polymerase I inhibitor

0.159 0.044 CID_999

0.1690.0090.207Carbamoyl phosphate synthetase inhibitor

0.207 0.007 CID_999

CID_999
0.1630.0090.333Integrin antagonist

0.333 0.005 CID_999

CID_999
0.1630.0090.163Glutathione S-transferase inhibitor

0.161 0.01 CID_999

0.2330.080.233Vasodilator

0.192 0.111 CID_999

0.2390.0870.239DNA damaging

0.229 0.093 CID_999

0.1640.0130.298Cell adhesion molecule inhibitor

0.298 0.005 CID_999

CID_999
0.1640.0130.169Interleukin 1 beta converting enzyme inhibitor

0.169 0.011 CID_999

CID_999
0.1570.0060.157Purinergic P2X1 antagonist

0.151 0.007 CID_999

0.1620.0120.162Anabolic

0.152 0.017 CID_999

0.1580.010.158Vanilloid agonist

0.132 0.014 CID_999

0.160.0120.16Adrenaline agonist

0.117 0.027 CID_999

0.2170.0690.217Amyloid beta aggregation inhibitor
0.1540.0060.154NMDA 2C receptor antagonist

0.134 0.008 CID_999

0.1730.0260.173Nav1.4 sodium channel blocker

0.159 0.03 CID_999

0.230.0840.246Calpain inhibitor

0.246 0.069 CID_999

CID_999
0.1830.0380.183Cell wall synthesis inhibitor

0.181 0.039 CID_999

0.160.0160.16NAD(P)H dehydrogenase (quinone) inhibitor

0.123 0.028 CID_999

0.1470.0050.147Leukotriene B4 antagonist

0.124 0.007 CID_999

0.1520.0110.16Lanosterol 14 alpha demethylase inhibitor

0.16 0.009 CID_999

CID_999
0.1510.0110.151Estrogen agonist
0.1560.0170.16Selectin antagonist

0.16 0.016 CID_999

CID_999
0.1430.0040.143Liver X receptor alpha agonist

0.126 0.004 CID_999

0.180.0420.183Hemostatic

0.183 0.041 CID_999

CID_999
0.1710.0330.198Cathepsin H inhibitor

0.198 0.023 CID_999

CID_999
0.1410.0040.155Prostaglandin agonist

0.155 0.004 CID_999

CID_999
0.1490.0170.149NMDA 2 receptor antagonist

0.099 0.032 CID_999

0.3020.1710.302Apoptosis agonist
0.1350.0040.17AMPA 4 receptor antagonist

0.17 0.004 CID_999

CID_999
0.1340.0030.134Dopamine D5 agonist

0.093 0.005 CID_999

0.1360.0080.136D-Ala-D-Ala ligase inhibitor

0.116 0.016 CID_999

0.1370.0090.151Glycine receptor agonist

0.151 0.007 CID_999

CID_999
0.1730.0460.173Alkaline phosphatase inhibitor

0.136 0.07 CID_999

0.1380.0110.138Leukotriene synthesis inhibitor

0.13 0.013 CID_999

0.1340.0080.151Peroxisome proliferator-activated receptor alpha agonist

0.151 0.006 CID_999

CID_999
0.130.0040.177Carnitine palmitoyltransferase 1B inhibitor

0.177 0.003 CID_999

CID_999
0.140.0140.14Ornithine decarboxylase inhibitor

0.14 0.014 CID_999

0.130.0040.156DNA helicase inhibitor

0.156 0.003 CID_999

CID_999
0.1350.0110.135HIV-1 integrase inhibitor

0.106 0.022 CID_999

0.1270.0040.151Retinoid X alpha receptor agonist

0.151 0.003 CID_999

CID_999
0.1380.0150.138CDC25A inhibitor

0.129 0.017 CID_999

0.1680.0450.189M17 leucyl aminopeptidase inhibitor

0.189 0.037 CID_999

CID_999
0.1450.0240.145Toll-Like receptor 4 antagonist

0.121 0.042 CID_999

0.1290.0080.145Peroxisome proliferator-activated receptor gamma antagonist

0.145 0.006 CID_999

CID_999
0.1310.010.134Granulocyte macrophage colony stimulating factor agonist

0.134 0.009 CID_999

CID_999
0.1260.0050.203Sphingosine 1-phosphate receptor 5 agonist

0.203 0.004 CID_999

CID_999
0.1350.0160.135Interleukin 5 antagonist

0.131 0.017 CID_999

0.1310.0110.131Carbonic anhydrase VB inhibitor

0.108 0.014 CID_999

0.1260.0060.146Thromboxane antagonist

0.146 0.005 CID_999

CID_999
0.1330.0150.14Glutamate release inhibitor

0.14 0.013 CID_999

CID_999
0.1480.030.152Caspase 3 inhibitor

0.152 0.027 CID_999

CID_999
0.120.0020.12Thyroid hormone agonist

0.076 0.003 CID_999

0.1220.0040.129Glutamate (mGluR7) antagonist

0.129 0.004 CID_999

CID_999
0.1280.0110.176Acyl-CoA dehydrogenase inhibitor

0.176 0.007 CID_999

CID_999
0.2140.0970.214Neuropeptide Y2 antagonist

0.214 0.096 CID_999

0.1580.0420.158Alkylator

0.146 0.048 CID_999

0.120.0060.165Kainate receptor antagonist

0.165 0.004 CID_999

CID_999
0.160.0470.16M18 aspartyl aminopeptidase inhibitor
0.1170.0050.196Fumarate hydratase inhibitor

0.196 0.003 CID_999

CID_999
0.1210.0090.121NMDA 2A receptor antagonist

0.098 0.014 CID_999

0.1140.0030.132Prostaglandin EP4 agonist

0.132 0.003 CID_999

CID_999
0.2210.110.221Transcription factor STAT3 inhibitor

0.199 0.134 CID_999

0.1180.0080.118CD45 antagonist

0.102 0.009 CID_999

0.1540.0430.155Antibacterial (Helicobacter pylori)

0.155 0.042 CID_999

CID_999
0.1160.0060.15Glutamate (mGluR6) antagonist

0.15 0.004 CID_999

CID_999
0.1270.0170.127HIV-1 integrase (3'-Processing) inhibitor

0.069 0.039 CID_999

0.1480.0380.158Microtubule formation inhibitor

0.158 0.034 CID_999

CID_999
0.1210.0120.1213-Oxoacyl-[acyl-carrier-protein] synthase inhibitor

0.082 0.024 CID_999

0.1180.0090.146NMDA receptor glycine site agonist

0.146 0.005 CID_999

CID_999
0.130.0210.13Interleukin 12 antagonist

0.099 0.055 CID_999

0.1420.0340.142Bronchodilator

0.105 0.058 CID_999

0.1110.0040.19Glutamate (mGluR3) antagonist

0.19 0.004 CID_999

CID_999
0.1110.0050.117Urate transporter 1 inhibitor

0.117 0.005 CID_999

CID_999
0.2170.1110.2175 Hydroxytryptamine 1E antagonist

0.205 0.125 CID_999

0.1090.0040.109Leukotriene C antagonist

0.108 0.004 CID_999

0.110.0060.134Thromboxane A2 antagonist

0.134 0.004 CID_999

CID_999
0.1070.0030.107ATP citrate lysase inhibitor

0.077 0.004 CID_999

0.1080.0040.125Retinoid X receptor agonist

0.125 0.003 CID_999

CID_999
0.1150.0120.115Maillard reaction inhibitor

0.097 0.018 CID_999

0.1070.0050.229Diacylglycerol O-acyltransferase 1 inhibitor

0.229 0.004 CID_999

CID_999
0.1050.0040.119Glucose-6-phosphate isomerase inhibitor

0.119 0.004 CID_999

CID_999
0.1480.0480.151Proteasome inhibitor

0.151 0.046 CID_999

CID_999
0.1180.0180.15Interferon agonist

0.15 0.01 CID_999

CID_999
0.1170.0170.117HIV-1 integrase (Strand Transfer) inhibitor

0.074 0.034 CID_999

0.1030.0040.119Prostaglandin E2 agonist

0.119 0.004 CID_999

CID_999
0.1090.010.109Estrogen receptor beta agonist
0.1180.0190.118Estrogen receptor alpha antagonist

0.08 0.049 CID_999

0.1050.0090.105MAP kinase kinase 7 inhibitor

0.088 0.028 CID_999

0.1010.0050.101Nicotinic acid receptor agonist

0.088 0.005 CID_999

0.1050.0090.1053(or 17)beta-hydroxysteroid dehydrogenase inhibitor

0.07 0.022 CID_999

0.2140.1190.214Transcription factor STAT inhibitor

0.191 0.151 CID_999

0.0980.0030.119Kainate receptor agonist

0.119 0.002 CID_999

CID_999
0.1220.0280.125Histamine N-methyltransferase inhibitor

0.125 0.026 CID_999

CID_999
0.0990.0050.121Lysophosphatidic acid 3 receptor antagonist

0.121 0.004 CID_999

CID_999
0.0980.0040.098Liver X receptor beta antagonist

0.092 0.004 CID_999

0.0980.0050.116Liver X receptor antagonist

0.116 0.005 CID_999

CID_999
0.0960.0040.11Liver X receptor alpha antagonist

0.11 0.004 CID_999

CID_999
0.1750.0840.175P-glycoprotein inhibitor

0.17 0.09 CID_999

0.1380.0470.138Papain-like protease (SARS coronavirus) inhibitor
0.1010.010.102Plasminogen activator inhibitor antagonist

0.102 0.01 CID_999

CID_999
0.1040.0150.104Beta adrenoreceptor antagonist

0.084 0.024 CID_999

0.0960.0060.163Integrin alpha4 antagonist

0.163 0.004 CID_999

CID_999
0.0950.0060.123VLA-4 antagonist

0.123 0.005 CID_999

CID_999
0.0970.0090.097Estrogen receptor alpha agonist
0.0930.0050.1Liver X receptor beta agonist

0.1 0.005 CID_999

CID_999
0.1310.0430.131Transcription factor STAT6 inhibitor

0.124 0.053 CID_999

0.0920.0040.098Heparanase inhibitor

0.098 0.004 CID_999

CID_999
0.1330.0460.145Falcipain 3 inhibitor

0.145 0.039 CID_999

CID_999
0.0940.0070.111Thromboxane synthase inhibitor

0.111 0.005 CID_999

CID_999
0.1010.0140.101Beta 3 adrenoreceptor antagonist

0.077 0.026 CID_999

0.0990.0120.111Prostaglandin F2 alpha antagonist

0.111 0.008 CID_999

CID_999
0.0910.0040.091Dopamine beta hydroxylase inhibitor

0.077 0.005 CID_999

0.0950.0090.114MDM2 inhibitor

0.114 0.004 CID_999

CID_999
0.0920.0060.12Peroxisome proliferator-activated receptor delta agonist

0.12 0.005 CID_999

CID_999
0.1580.0730.22Anticoagulant

0.22 0.046 CID_999

CID_999
0.0890.0050.108Peroxisome proliferator-activated receptor alpha antagonist

0.108 0.004 CID_999

CID_999
0.090.0060.108AMPA 1 receptor antagonist

0.108 0.005 CID_999

CID_999
0.1820.10.2065 Hydroxytryptamine 3E antagonist

0.206 0.052 CID_999

CID_999
0.1230.0420.123Urease inhibitor

0.111 0.054 CID_999

0.0950.0150.117Interferon inducer

0.117 0.008 CID_999

CID_999
0.0860.0070.127Glutamate (mGluR4) antagonist

0.127 0.004 CID_999

CID_999
0.10.0220.1CC chemokine 5 receptor agonist

0.091 0.034 CID_999

0.1110.0320.12Phosphodiesterase 4D inhibitor

0.12 0.028 CID_999

CID_999
0.1160.0380.116Opioid antagonist
0.0810.0040.082Leukotriene C4 antagonist

0.082 0.004 CID_999

CID_999
0.0890.0120.092Sphingosine 1-phosphate receptor 3 antagonist

0.092 0.01 CID_999

CID_999
0.080.0040.095Glutamate (mGluR8) agonist

0.095 0.003 CID_999

CID_999
0.080.0040.083-Hydroxyanthranilate 3,4-dioxygenase inhibitor

0.072 0.004 CID_999

0.0820.0070.122Glutamate (mGluR group III) antagonist

0.122 0.004 CID_999

CID_999
0.1040.0290.104Opioid delta receptor antagonist
0.0940.0190.182GP IIb/IIIa receptor antagonist

0.182 0.008 CID_999

CID_999
0.0920.0180.133Ornithine carbamoyltransferase inhibitor

0.133 0.011 CID_999

CID_999
0.0960.0220.101Elastase 1 inhibitor

0.101 0.019 CID_999

CID_999
0.0790.0050.115Prostacyclin antagonist

0.115 0.004 CID_999

CID_999
0.0780.0040.103Free fatty acid receptor 1 antagonist

0.103 0.003 CID_999

CID_999
0.090.0170.121Mannitol-1-phosphate 5-dehydrogenase inhibitor

0.121 0.011 CID_999

CID_999
0.0970.0240.101Sphingosine 1-phosphate receptor antagonist

0.101 0.021 CID_999

CID_999
0.0870.0140.087Beta 1 adrenoreceptor antagonist

0.077 0.02 CID_999

0.0830.010.094Alpha-mannosidase inhibitor

0.094 0.007 CID_999

CID_999
0.0770.0040.142Free fatty acid receptor 1 agonist

0.142 0.004 CID_999

CID_999
0.1560.0840.156Mcl-1 antagonist
0.0790.0070.123Kainate receptor 2 antagonist

0.123 0.004 CID_999

CID_999
0.0830.0110.083Beta 2 adrenoreceptor antagonist

0.067 0.018 CID_999

0.0860.0150.086Carbonic anhydrase XIV inhibitor

0.06 0.025 CID_999

0.1070.0350.108Metalloproteinase-2 inhibitor

0.108 0.035 CID_999

CID_999
0.0870.0150.107AMPA receptor antagonist

0.107 0.01 CID_999

CID_999
0.0810.010.101Liver X receptor agonist

0.101 0.007 CID_999

CID_999
0.1020.0310.128Glycine receptor antagonist

0.128 0.014 CID_999

CID_999
0.080.0090.08Beta 2 adrenoreceptor agonist

0.069 0.021 CID_999

0.1470.0770.149Acetylcholine M1 receptor antagonist

0.149 0.076 CID_999

CID_999
0.0820.0120.0915-Alpha-reductase inhibitor

0.091 0.011 CID_999

CID_999
0.0750.0050.117Lysophosphatidic acid 2 receptor antagonist

0.117 0.004 CID_999

CID_999
0.0830.0130.12Diacylglycerol O-acyltransferase inhibitor

0.12 0.005 CID_999

CID_999
0.0790.0090.079Ryanodine receptor antagonist

0.072 0.015 CID_999

0.0960.0270.096Amidase inhibitor

0.095 0.027 CID_999

0.10.0320.1Na+ K+ transporting ATPase inhibitor

0.097 0.035 CID_999

0.0760.0090.078Pregnane X receptor antagonist

0.078 0.007 CID_999

CID_999
0.0780.0110.08Dihydroorotate oxidase inhibitor

0.08 0.011 CID_999

CID_999
0.0690.0020.069Thyroid hormone beta agonist

0.032 0.003 CID_999

0.1120.0460.139Folate antagonist

0.139 0.027 CID_999

CID_999
0.0750.010.088Mannosidase inhibitor

0.088 0.007 CID_999

CID_999
0.0980.0320.098Opioid mu receptor antagonist
0.0740.0090.079AICAR transformylase inhibitor

0.079 0.008 CID_999

CID_999
0.1350.070.142Interleukin 1 antagonist

0.142 0.063 CID_999

CID_999
0.0750.010.096Sphingosine 1-phosphate receptor agonist

0.096 0.006 CID_999

CID_999
0.1540.090.159Antipruritic

0.159 0.085 CID_999

CID_999
0.0810.0170.089Bombesin 2 receptor antagonist

0.089 0.015 CID_999

CID_999
0.1150.0510.115Beta glucuronidase inhibitor
0.0810.0170.081Glycine transporter 2 inhibitor

0.062 0.024 CID_999

0.0680.0050.105AMPA 3 receptor antagonist

0.105 0.004 CID_999

CID_999
0.080.0170.081Botulinum neurotoxin type A inhibitor

0.081 0.016 CID_999

CID_999
0.0840.0220.084Androgen agonist

0.071 0.03 CID_999

0.0760.0140.076Topoisomerase II beta inhibitor

0.06 0.022 CID_999

0.1560.0950.156Amyloid beta precursor protein antagonist
0.0670.0060.099Prostaglandin EP4 antagonist

0.099 0.004 CID_999

CID_999
0.1150.0550.115Multidrug resistance-associated protein 1 inhibitor

0.108 0.065 CID_999

0.1270.0670.136Glutamate receptor antagonist

0.136 0.061 CID_999

CID_999
0.0710.0120.079Adenylate cyclase 1 inhibitor

0.079 0.008 CID_999

CID_999
0.0640.0050.072Retinoid X receptor antagonist

0.072 0.004 CID_999

CID_999
0.0640.0050.0661-Alkyl-2-acetylglycerophosphocholine esterase inhibitor

0.066 0.005 CID_999

CID_999
0.0750.0160.083Sphingosine 1-phosphate receptor 1 antagonist

0.083 0.013 CID_999

CID_999
0.0820.0230.082Xanthine dehydrogenase inhibitor

0.052 0.044 CID_999

0.0840.0250.084CDC25B inhibitor

0.071 0.037 CID_999

0.0630.0050.072Leukotriene B4 receptor 1 antagonist

0.072 0.004 CID_999

CID_999
0.0650.0060.065Beta adrenoreceptor agonist

0.052 0.014 CID_999

0.0860.0280.095Neutrophil collagenase inhibitor

0.095 0.024 CID_999

CID_999
0.0660.0080.112AMPA 2 receptor antagonist

0.112 0.005 CID_999

CID_999
0.1390.0820.166Thiol protease inhibitor

0.166 0.057 CID_999

CID_999
0.0820.0250.11Carbonic anhydrase stimulant

0.11 0.016 CID_999

CID_999
0.0660.010.078Sphingosine 1-phosphate receptor 1 agonist

0.078 0.006 CID_999

CID_999
0.070.0140.076Adenosine deaminase inhibitor

0.076 0.011 CID_999

CID_999
0.2240.1680.26Calpain 2 inhibitor

0.26 0.142 CID_999

CID_999
0.0690.0130.069CXC chemokine 1 receptor antagonist

0.056 0.027 CID_999

0.0590.0040.059Prostaglandin F2 alpha agonist

0.057 0.004 CID_999

0.1070.0520.134Sphingomyelinase inhibitor

0.134 0.032 CID_999

CID_999
0.0630.0080.08p53 inhibitor

0.08 0.004 CID_999

CID_999
0.1370.0820.144Pregnane X receptor agonist

0.144 0.064 CID_999

CID_999
0.0640.0090.068Arginase inhibitor

0.068 0.008 CID_999

CID_999
0.0590.0040.059Glutamate (mGluR3) agonist

0.054 0.004 CID_999

0.0680.0130.075Thymidylate synthase inhibitor

0.075 0.009 CID_999

CID_999
0.080.0250.08Ribonucleoside-diphosphate reductase inhibitor

0.069 0.029 CID_999

0.1730.1180.173Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase inhibitor

0.16 0.131 CID_999

0.1140.0590.133Acetylcholine release stimulant

0.133 0.03 CID_999

CID_999
0.0910.0370.091Metalloproteinase-9 inhibitor

0.089 0.038 CID_999

0.1220.0680.126DNA repair enzyme inhibitor

0.126 0.061 CID_999

CID_999
0.0810.0260.081Ribonucleotide reductase inhibitor

0.071 0.031 CID_999

0.0810.0260.091Protease 3C (Human rhinovirus) inhibitor

0.091 0.02 CID_999

CID_999
0.0640.010.064Dihydropteroate synthase inhibitor

0.055 0.014 CID_999

0.0630.0090.087GABA uptake inhibitor

0.087 0.004 CID_999

CID_999
0.0730.020.073Sphingosine kinase 2 inhibitor

0.07 0.021 CID_999

0.0570.0040.11Retinoid X beta receptor agonist

0.11 0.003 CID_999

CID_999
0.0680.0150.106Macrophage elastase inhibitor

0.106 0.009 CID_999

CID_999
0.0690.0160.069Adenine nucleotide translocase inhibitor

0.058 0.032 CID_999

0.0550.0030.059Thyroid hormone alpha agonist

0.059 0.003 CID_999

CID_999
0.0710.020.078Phosphorylase inhibitor

0.078 0.017 CID_999

CID_999
0.0780.0260.096Aminopeptidase microsomal inhibitor

0.096 0.019 CID_999

CID_999
0.0550.0040.075Tryptophan 5 hydroxylase inhibitor

0.075 0.003 CID_999

CID_999
0.0990.0490.099Thioredoxin inhibitor

0.082 0.077 CID_999

0.0550.0060.068Carnitine palmitoyltransferase inhibitor

0.068 0.004 CID_999

CID_999
0.0540.0050.062Prostaglandin EP2 agonist

0.062 0.004 CID_999

CID_999
0.0650.0160.073Immunoglobulin Fc receptor antagonist

0.073 0.009 CID_999

CID_999
0.0540.0050.102Retinoid X gamma receptor agonist

0.102 0.004 CID_999

CID_999
0.0540.0050.063Retinoid X alpha receptor antagonist

0.063 0.004 CID_999

CID_999
0.0770.0290.094Exportin-1 inhibitor

0.094 0.012 CID_999

CID_999
0.150.1020.1733C-like protease (Human coronavirus) inhibitor

0.173 0.071 CID_999

CID_999
0.0710.0230.071Sphingosine kinase inhibitor

0.069 0.026 CID_999

0.0610.0130.072Geranyltranstransferase inhibitor

0.072 0.007 CID_999

CID_999
0.2050.1580.27Immunomodulator

0.27 0.1 CID_999

CID_999
0.0530.0060.065Carnitine palmitoyltransferase 1 inhibitor

0.065 0.004 CID_999

CID_999
0.0590.0120.067Guanylate cyclase inhibitor

0.067 0.006 CID_999

CID_999
0.1140.0670.144Interleukin 1b antagonist

0.144 0.045 CID_999

CID_999
0.0910.0450.091Opioid kappa receptor antagonist
0.0890.0440.105Chymotrypsin inhibitor

0.105 0.033 CID_999

CID_999
0.0520.0070.061Prostaglandin D2 agonist

0.061 0.005 CID_999

CID_999
0.0560.0110.056RNA-directed RNA polymerase inhibitor

0.049 0.013 CID_999

0.0490.0040.059Prostaglandin H2 antagonist

0.059 0.003 CID_999

CID_999
0.1020.0560.133Glutamate (mGluR7) agonist

0.133 0.02 CID_999

CID_999
0.1120.0670.112Protein kinase (CK2) alpha inhibitor

0.112 0.067 CID_999

0.0490.0050.093Glutamate (mGluR1) agonist

0.093 0.004 CID_999

CID_999
0.0490.0050.094Glutamate (mGluR1a) agonist

0.094 0.004 CID_999

CID_999
0.0490.0050.087Kainate receptor 1 antagonist

0.087 0.004 CID_999

CID_999
0.0850.0420.085Analgesic, opioid
0.0480.0040.052Leukotriene B4 receptor 2 antagonist

0.052 0.004 CID_999

CID_999
0.0510.0080.064Glutamate (mGluR8) antagonist

0.064 0.005 CID_999

CID_999
0.0790.0370.1Phospholipase D inhibitor

0.1 0.014 CID_999

CID_999
0.0470.0050.047Protocollagen prolyl hydroxylase inhibitor

0.046 0.006 CID_999

0.0510.010.051HCV NS5B polymerase inhibitor

0.041 0.014 CID_999

0.0470.0060.056NMDA receptor glycine site antagonist

0.056 0.005 CID_999

CID_999
0.0480.0080.059Lysine carboxypeptidase inhibitor

0.059 0.006 CID_999

CID_999
0.050.010.069Leukotriene D4 antagonist

0.069 0.008 CID_999

CID_999
0.0550.0150.066GABA B receptor antagonist

0.066 0.01 CID_999

CID_999
0.0460.0070.082Integrin beta7 antagonist

0.082 0.005 CID_999

CID_999
0.0850.0460.085Somatostatin 1 agonist
0.0890.050.089Myeloperoxidase inhibitor

0.081 0.065 CID_999

0.0460.0070.046Estrogen-related receptor beta antagonist
0.0570.0190.057Oxytocin agonist

0.044 0.028 CID_999

0.0810.0420.081Lipase inhibitor
0.060.0220.06Vanilloid 2 antagonist

0.05 0.041 CID_999

0.0430.0050.052Nicotinic acid receptor 2 antagonist

0.052 0.004 CID_999

CID_999
0.0420.0040.042Vanilloid 2 agonist

0.041 0.004 CID_999

0.0630.0250.063Epithelial sodium channel blocker

0.063 0.024 CID_999

0.0430.0050.077Integrin alpha4beta7 antagonist

0.077 0.004 CID_999

CID_999
0.0490.0120.074Integrin alpha2 antagonist

0.074 0.005 CID_999

CID_999
0.0570.0210.057Estradiol 17 beta-dehydrogenase inhibitor
0.0510.0140.069Squalene synthetase inhibitor

0.069 0.01 CID_999

CID_999
0.0770.0410.091Prostaglandin-E synthase inhibitor

0.091 0.032 CID_999

CID_999
0.050.0140.056Heme oxygenase inhibitor

0.056 0.008 CID_999

CID_999
0.0410.0050.066Lysophosphatidic acid receptor 1 agonist

0.066 0.003 CID_999

CID_999
0.0740.0390.075Glucagon-like peptide 1 agonist

0.075 0.038 CID_999

CID_999
0.040.0050.04Estrogen-related receptor gamma antagonist

0.033 0.011 CID_999

0.0380.0040.038Egl nine homolog 1 inhibitor

0.033 0.004 CID_999

0.0470.0120.05VCAM-1 antagonist

0.05 0.009 CID_999

CID_999
0.0380.0040.038Nicotinic acid receptor 1 antagonist

0.029 0.004 CID_999

0.0850.050.096Caspase 7 inhibitor

0.096 0.034 CID_999

CID_999
0.0470.0120.05VCAM antagonist

0.05 0.009 CID_999

CID_999
0.0460.0120.05Vanilloid 3 antagonist

0.05 0.009 CID_999

CID_999
0.0960.0620.096Phosphodiesterase 6D inhibitor

0.092 0.071 CID_999

0.0510.0170.061Angiotensin AT1 receptor antagonist

0.061 0.005 CID_999

CID_999
0.0880.0540.095Hematopoietic

0.095 0.041 CID_999

CID_999
0.0440.010.055Uridine phosphorylase inhibitor

0.055 0.007 CID_999

CID_999
0.0840.050.084Topoisomerase II alpha inhibitor
0.0380.0050.06Lysophosphatidic acid 1 receptor antagonist

0.06 0.003 CID_999

CID_999
0.0680.0350.068Aromatase inhibitor
0.0740.0410.079Matrix metalloproteinase inhibitor

0.079 0.038 CID_999

CID_999
0.040.0080.111Vitronectin receptor antagonist

0.111 0.004 CID_999

CID_999
0.0490.0170.069Membrane dipeptidase inhibitor

0.069 0.007 CID_999

CID_999
0.0670.0350.082Caspase 9 inhibitor

0.082 0.022 CID_999

CID_999
0.0410.0090.073Kynurenine 3 monooxygenase inhibitor

0.073 0.004 CID_999

CID_999
0.0360.0040.066G-protein-coupled receptor 120 agonist

0.066 0.003 CID_999

CID_999
0.0350.0040.035Estrogen-related receptor gamma agonist

0.024 0.006 CID_999

0.0430.0120.084Prostaglandin EP3 antagonist

0.084 0.007 CID_999

CID_999
0.0540.0240.06Cholesterol esterase inhibitor

0.06 0.018 CID_999

CID_999
0.0460.0160.048Phosphoglycerate kinase inhibitor

0.048 0.015 CID_999

CID_999
0.0490.0190.063Integrin alpha5beta1 antagonist

0.063 0.01 CID_999

CID_999
0.0470.0170.047Estradiol 17 beta-dehydrogenase 2 inhibitor
0.0370.0080.0525-Alpha-reductase 2 inhibitor

0.052 0.007 CID_999

CID_999
0.0420.0130.042Catechol O-methyltransferase inhibitor
0.0390.010.055Carnitine palmitoyltransferase 1A inhibitor

0.055 0.006 CID_999

CID_999
0.0560.0270.076Aminopeptidase N inhibitor

0.076 0.018 CID_999

CID_999
0.050.0220.05Erythropoietin receptor agonist

0.042 0.027 CID_999

0.0420.0140.042Estradiol 17 beta-dehydrogenase 3 inhibitor
0.0510.0240.062Fructose-1,6-bisphosphatase inhibitor

0.062 0.016 CID_999

CID_999
0.0640.0360.064Enoyl-[acyl-carrier-protein] reductase inhibitor
0.0590.0320.065Angiotensin-converting enzyme inhibitor

0.065 0.024 CID_999

CID_999
0.0590.0320.059Alpha tubulin antagonist
0.0560.0290.056Glucose-6-phosphate translocase inhibitor
0.0590.0330.067Matrix metalloproteinase (membrane-type) inhibitor

0.067 0.026 CID_999

CID_999
0.0350.0080.057Integrin alpha2beta1 antagonist

0.057 0.004 CID_999

CID_999
0.0960.070.109Gastric antisecretory

0.109 0.054 CID_999

CID_999
0.0320.0060.041Aminopeptidase A inhibitor

0.041 0.004 CID_999

CID_999
0.0830.0570.098Inducible nitric-oxide synthase inhibitor

0.098 0.039 CID_999

CID_999
0.0550.030.066Prolyl endopeptidase inhibitor

0.066 0.019 CID_999

CID_999
0.2290.2040.229Analgesic

0.227 0.206 CID_999

0.0520.0270.052Opioid mu receptor agonist
0.0530.0280.053Squalene epoxidase inhibitor

0.05 0.034 CID_999

0.040.0150.053Angiotensin II receptor antagonist

0.053 0.005 CID_999

CID_999
0.0750.0510.094Vanilloid 4 agonist

0.094 0.022 CID_999

CID_999
0.0420.0180.042Nicotinic acid receptor 2 agonist

0.036 0.024 CID_999

0.0310.0080.031Beta 1 adrenoreceptor agonist

0.024 0.014 CID_999

0.0530.030.066Antimetabolite

0.066 0.023 CID_999

CID_999
0.0270.0040.027Antibiotic Anthracycline-like

0.024 0.006 CID_999

0.1160.0960.116Histone deacetylase SIRT1 inhibitor
0.0830.0620.083Antineoplastic alkaloid
0.0260.0060.035Retinoid X beta receptor antagonist

0.035 0.004 CID_999

CID_999
0.0370.0170.048Melatonin receptor 1A agonist

0.048 0.009 CID_999

CID_999
0.0240.0040.027Glutamate (mGluR6) agonist

0.027 0.003 CID_999

CID_999
0.040.020.04Calcitonin receptor agonist

0.037 0.022 CID_999

0.0490.0290.049Carbonic anhydrase VII inhibitor
0.0280.0080.031ICAM 1 antagonist

0.031 0.006 CID_999

CID_999
0.0980.0790.0985 Hydroxytryptamine 3A agonist

0.097 0.079 CID_999

0.040.0210.052Sphingosine 1-phosphate receptor 3 agonist

0.052 0.015 CID_999

CID_999
0.0230.0050.03Thromboxane A2 agonist

0.03 0.003 CID_999

CID_999
0.0630.0450.074Calcium channel P-type blocker

0.074 0.021 CID_999

CID_999
0.0410.0230.051Farnesoid X receptor agonist

0.051 0.014 CID_999

CID_999
0.1050.0870.111Sphingosine 1-phosphate receptor 2 agonist

0.111 0.072 CID_999

CID_999
0.0340.0170.034Glucagon receptor antagonist

0.034 0.017 CID_999

0.0250.0080.027Neuraminidase (Influenza B) inhibitor

0.027 0.006 CID_999

CID_999
0.0720.0550.091S-adenosyl-L-methionine decarboxylase inhibitor

0.091 0.021 CID_999

CID_999
0.0490.0330.059Cytokine production stimulant

0.059 0.014 CID_999

CID_999
0.0350.0190.041Carboxypeptidase B inhibitor

0.041 0.012 CID_999

CID_999
0.0590.0430.075Collagenase 3 inhibitor

0.075 0.028 CID_999

CID_999
0.0460.0310.046Neurotensin receptor antagonist
0.050.0340.05Factor III inhibitor
0.0440.0290.058Leukocyte elastase inhibitor

0.058 0.019 CID_999

CID_999
0.040.0250.04CF transmembrane conductance regulator antagonist

0.038 0.036 CID_999

0.0460.0310.055Oleamide hydrolase inhibitor

0.055 0.023 CID_999

CID_999
0.0570.0420.057Lipocortins synthesis agonist
0.0240.0090.032Integrin alphaVbeta1 antagonist

0.032 0.005 CID_999

CID_999
0.0290.0140.029Sodium/glucose cotransporter 2 inhibitor

0.026 0.019 CID_999

0.0190.0040.019Integrin beta6 antagonist

0.018 0.005 CID_999

0.0250.010.05Integrin beta5 antagonist

0.05 0.005 CID_999

CID_999
0.0430.0290.069Glutamate (mGluR group III) agonist

0.069 0.015 CID_999

CID_999
0.020.0060.02Vitamin D receptor agonist

0.02 0.007 CID_999

0.10.0860.1Topoisomerase II inhibitor
0.0250.0110.038Integrin alphaVbeta3 antagonist

0.038 0.005 CID_999

CID_999
0.0180.0040.024Thromboxane agonist

0.024 0.003 CID_999

CID_999
0.0180.0050.018Beta 3 adrenoreceptor agonist

0.011 0.009 CID_999

0.0210.0080.021Ileal bile acid transport inhibitor

0.018 0.01 CID_999

0.0830.0710.083Aminoacyl-tRNA synthetase inhibitor
0.020.0080.02Telomerase stimulant

0.02 0.007 CID_999

0.0490.0370.095Prostaglandin E2 antagonist

0.095 0.016 CID_999

CID_999
0.0340.0230.038Calcium-independent phospholipase A2 inhibitor

0.038 0.014 CID_999

CID_999
0.0280.0170.028Urotensin II agonist

0.027 0.018 CID_999

0.0270.0160.027Sodium/glucose cotransporter inhibitor

0.025 0.02 CID_999

0.1010.090.103Acetylcholine muscarinic antagonist

0.103 0.087 CID_999

CID_999
0.0410.030.044Sphingosine kinase 1 inhibitor

0.044 0.024 CID_999

CID_999
0.1480.1370.148Aryl hydrocarbon receptor agonist
0.020.0090.022Methylmalonyl-CoA mutase inhibitor

0.022 0.006 CID_999

CID_999
0.0320.0210.044Methionyl aminopeptidase 1 inhibitor

0.044 0.009 CID_999

CID_999
0.0350.0250.039Ceramide glucosyltransferase inhibitor

0.039 0.019 CID_999

CID_999
0.0310.0210.035Elastase 3B inhibitor

0.035 0.013 CID_999

CID_999
0.0310.0210.035Elastase 3A inhibitor

0.035 0.013 CID_999

CID_999
0.0310.0210.035Elastase 2B inhibitor

0.035 0.013 CID_999

CID_999
0.0420.0310.049Carbonic anhydrase IV inhibitor

0.049 0.025 CID_999

CID_999
0.0940.0840.122GABA receptor agonist

0.122 0.055 CID_999

CID_999
0.0150.0050.015Egl nine homolog 3 inhibitor

0.014 0.006 CID_999

0.0280.0180.03Hedgehog signaling activator

0.03 0.013 CID_999

CID_999
0.0230.0140.025Isoleucine-tRNA ligase inhibitor

0.025 0.01 CID_999

CID_999
0.1240.1140.124Neuropeptide Y1 antagonist
0.0340.0250.038HMG CoA reductase inhibitor

0.038 0.017 CID_999

CID_999
0.0350.0250.035Growth factor receptor-bound protein 2 antagonist

0.035 0.025 CID_999

0.0190.010.027Integrin alpha4beta1 antagonist

0.027 0.008 CID_999

CID_999
0.0160.0080.017Integrin alphaVbeta6 antagonist

0.017 0.007 CID_999

CID_999
0.0270.0190.033Retinoid X gamma receptor antagonist

0.033 0.009 CID_999

CID_999
0.0570.0490.057Carbonic anhydrase inhibitor
0.0850.0770.085Protein kinase (CK2) inhibitor

0.085 0.077 CID_999

0.0420.0340.049Dihydrofolate reductase inhibitor

0.049 0.019 CID_999

CID_999
0.0380.030.044Retinoic acid alpha receptor agonist

0.044 0.02 CID_999

CID_999
0.0180.0110.0275-Alpha-reductase 1 inhibitor

0.027 0.009 CID_999

CID_999
0.1130.1060.115Neurotrophic factor

0.115 0.104 CID_999

CID_999
0.0950.0880.113Anesthetic local

0.113 0.072 CID_999

CID_999
0.0370.030.048Integrin alpha1beta1 antagonist

0.048 0.009 CID_999

CID_999
0.0230.0160.023Estradiol 17 beta-dehydrogenase 1 inhibitor
0.060.0530.06Neuraminidase (influenza) inhibitor
0.020.0130.022Caspase 8 inhibitor

0.022 0.009 CID_999

CID_999
0.0270.020.03411-Beta-hydroxysteroid dehydrogenase 2 inhibitor

0.034 0.014 CID_999

CID_999
0.0170.0110.029Carbonic anhydrase VIII inhibitor

0.029 0.004 CID_999

CID_999
0.0170.0110.029Carbonic anhydrase X inhibitor

0.029 0.004 CID_999

CID_999
0.0320.0260.032Protein kinase (CK2) beta inhibitor

0.032 0.025 CID_999

0.0480.0420.048Opioid agonist
0.0430.0370.044Potassium channel Kv1.3 blocker

0.044 0.036 CID_999

CID_999
0.0140.0080.0171-Deoxy-D-xylulose-5-phosphate reductoisomerase inhibitor

0.017 0.005 CID_999

CID_999
0.0320.0270.04Glutamate (mGluR4) agonist

0.04 0.016 CID_999

CID_999
0.0790.0730.079Transcription factor NF kappa B stimulant
0.0090.0040.013Integrin alpha5beta6 antagonist

0.013 0.003 CID_999

CID_999
0.0390.0340.045Plasmepsin II inhibitor

0.045 0.022 CID_999

CID_999
0.0580.0530.058Heme oxygenase stimulant
0.0260.0210.026Baculoviral IAP repeat-containing protein 4 inhibitor

0.026 0.021 CID_999

0.0170.0120.022Tryptophan hydroxylase 1 inhibitor

0.022 0.005 CID_999

CID_999
0.030.0250.036Sirtuin 2 inhibitor

0.036 0.02 CID_999

CID_999
0.0760.0710.076Androgen antagonist
0.0250.0210.04Calcium-sensing receptor agonist

0.04 0.008 CID_999

CID_999
0.060.0560.06Transcription factor RelA inhibitor
0.0480.0440.065Autotaxin inhibitor

0.065 0.025 CID_999

CID_999
0.0360.0330.045Toll-Like receptor 2 agonist

0.045 0.026 CID_999

CID_999
0.1420.1390.244Anticonvulsant

0.244 0.059 CID_999

CID_999
0.0150.0120.021Prostacyclin agonist

0.021 0.008 CID_999

CID_999
0.1060.1020.126Nav1.2 sodium channel blocker

0.126 0.077 CID_999

CID_999
0.010.0070.014Integrin alphaVbeta5 antagonist

0.014 0.005 CID_999

CID_999
0.0130.010.022Angiotensin AT1B receptor antagonist

0.022 0.005 CID_999

CID_999
0.0170.0140.027CXC chemokine 5 receptor antagonist

0.027 0.005 CID_999

CID_999
0.0170.0150.023Complement factor D inhibitor

0.023 0.005 CID_999

CID_999
0.0370.0350.058Complement C3a chemotactic receptor antagonist

0.058 0.023 CID_999

CID_999
0.0140.0130.016Purinergic P2Y1 agonist

0.016 0.01 CID_999

CID_999
0.0520.0510.052Acetylcholine M3 receptor antagonist
0.0820.0810.082Protein kinase C zeta inhibitor
0.0280.0270.035Cholesterol ester transfer protein antagonist

0.035 0.017 CID_999

CID_999
0.0170.0160.045Integrin beta3 antagonist

0.045 0.007 CID_999

CID_999
0.030.030.035Purinergic P2Y2 antagonist

0.035 0.021 CID_999

CID_999
0.0210.020.022Retinoic acid gamma receptor agonist

0.022 0.017 CID_999

CID_999
0.110.1110.126Nav1.6 sodium channel blocker

0.126 0.086 CID_999

CID_999
0.0360.0380.049Thymidine kinase inhibitor

0.049 0.02 CID_999

CID_999
0.0110.0130.02Lysophosphatidic acid receptor 3 agonist

0.02 0.005 CID_999

CID_999
0.0150.0180.032Prostaglandin EP1 antagonist

0.032 0.009 CID_999

CID_999
0.0650.0680.089CYP2A6 inhibitor

0.089 0.042 CID_999

CID_999
0.0470.0510.054Plasminogen activator inhibitor

0.054 0.044 CID_999

CID_999
0.0120.0150.013Adenosine A2a receptor agonist

0.013 0.012 CID_999

CID_999
0.0170.0210.019Retinoic acid alpha receptor antagonist

0.019 0.016 CID_999

CID_999
0.020.0240.024Fructose-1,6-bisphosphatase 1 inhibitor

0.024 0.016 CID_999

CID_999
0.0410.0450.049Metalloproteinase-3 inhibitor

0.049 0.034 CID_999

CID_999
0.0090.0140.011Thrombopoietin agonist

0.011 0.01 CID_999

CID_999
0.0320.0370.043Glutamate (mGluR group II) antagonist

0.043 0.022 CID_999

CID_999
0.0170.0220.02Retinoic acid beta receptor agonist

0.02 0.014 CID_999

CID_999
0.0230.0280.032Endothelin receptor antagonist

0.032 0.016 CID_999

CID_999
0.0220.0280.025NMDA 2D receptor antagonist

0.025 0.022 CID_999

CID_999
0.0180.0240.023Thymidine kinase (Herpes simplex virus 2) inhibitor

0.023 0.009 CID_999

CID_999
0.0150.0220.027Neutral endopeptidase inhibitor

0.027 0.013 CID_999

CID_999
0.0220.030.03Acid ceramidase inhibitor

0.03 0.01 CID_999

CID_999
0.0220.0310.031LFA antagonist

0.031 0.014 CID_999

CID_999
0.0360.0460.05Nerve growth factor antagonist

0.05 0.018 CID_999

CID_999
0.0050.0140.007DNA topoisomerase III inhibitor

0.007 0.005 CID_999

CID_999
0.0240.0340.029Purinergic P2Y15 antagonist

0.029 0.018 CID_999

CID_999
0.0090.0190.013N-Acetylated alpha-linked acidic dipeptidase inhibitor

0.013 0.012 CID_999

CID_999
0.0260.0370.039Leukotriene A4 hydrolase inhibitor

0.039 0.026 CID_999

CID_999
0.0130.0240.016Angiotensin-converting enzyme 2 inhibitor

0.016 0.015 CID_999

CID_999
0.0230.0360.028Thymidine kinase (Herpes simplex virus 1) inhibitor

0.028 0.015 CID_999

CID_999
0.0360.0490.05Dihydroorotase inhibitor

0.05 0.025 CID_999

CID_999
0.090.1040.096Beta amyloid protein antagonist

0.096 0.095 CID_999

CID_999
0.0760.0910.097Protease inhibitor

0.097 0.068 CID_999

CID_999
0.0120.0270.018Kainate receptor 3 antagonist

0.018 0.01 CID_999

CID_999
0.0070.0230.014Integrin beta2 antagonist

0.014 0.008 CID_999

CID_999
0.0080.0240.013Carbonic anhydrase XI inhibitor

0.013 0.008 CID_999

CID_999
0.0160.0340.03Hypoxanthine phosphoribosyltransferase inhibitor

0.03 0.018 CID_999

CID_999
0.0520.070.066Phosphodiesterase 4B inhibitor

0.066 0.048 CID_999

CID_999
0.0530.0720.058Trypsin inhibitor

0.058 0.054 CID_999

CID_999
0.0310.050.04Purinergic P2Y antagonist

0.04 0.036 CID_999

CID_999
0.0570.0760.076Epoxide hydrolase inhibitor

0.076 0.046 CID_999

CID_999
0.040.060.049HCV NS3/NS4A protease inhibitor

0.049 0.035 CID_999

CID_999
0.060.080.068Adenosine A3 receptor antagonist

0.068 0.061 CID_999

CID_999
0.0780.10.101Nitric-oxide synthase inhibitor

0.101 0.058 CID_999

CID_999
0.0430.0650.058Nicotinic alpha3beta2 receptor antagonist

0.058 0.029 CID_999

CID_999
0.0250.0510.034AMPA receptor agonist

0.034 0.026 CID_999

CID_999
0.040.0650.066Glutamate (mGluR1) antagonist

0.066 0.033 CID_999

CID_999
0.020.0460.024Complement factor 1s inhibitor

0.024 0.022 CID_999

CID_999
0.0120.040.019Bombesin 3 receptor agonist

0.019 0.013 CID_999

CID_999
0.0190.0470.028Peptide deformylase inhibitor

0.028 0.023 CID_999

CID_999
0.0550.0830.097Glutamate receptor agonist

0.097 0.039 CID_999

CID_999
0.0110.0380.021Kainate receptor 5 antagonist

0.021 0.014 CID_999

CID_999
0.0270.0560.044Endothelin-converting enzyme inhibitor

0.044 0.035 CID_999

CID_999
0.0130.0430.024Kainate receptor 4 antagonist

0.024 0.018 CID_999

CID_999
0.0140.0450.022Bombesin agonist

0.022 0.015 CID_999

CID_999
0.0240.0540.04Diamine oxidase inhibitor

0.04 0.023 CID_999

CID_999
0.030.0620.041Stearoyl-CoA desaturase inhibitor

0.041 0.036 CID_999

CID_999
0.0210.0590.036TRPM8 blocker

0.036 0.03 CID_999

CID_999
0.020.0580.035G protein-coupled receptor agonist

0.035 0.029 CID_999

CID_999
0.0540.0960.105Calcium antagonist

0.105 0.045 CID_999

CID_999
0.0330.0780.049Aldosterone antagonist

0.049 0.03 CID_999

CID_999
0.0940.140.129Cytidine deaminase inhibitor

0.129 0.092 CID_999

CID_999
0.0510.0960.07Calcium channel L-type blocker

0.07 0.052 CID_999

CID_999
0.050.0990.081Histamine H1 receptor antagonist

0.081 0.056 CID_999

CID_999
0.070.120.078T cell inhibitor

0.078 0.075 CID_999

CID_999
0.010.0610.028Cholecystokinin B antagonist

0.028 0.024 CID_999

CID_999
0.1110.1640.133MAP kinase 3 inhibitor

0.133 0.099 CID_999

CID_999
0.0140.0680.047Cholecystokinin antagonist

0.047 0.026 CID_999

CID_999
0.0170.0730.029Epoxide hydrolase 1 inhibitor

0.029 0.026 CID_999

CID_999
0.0810.1390.098Factor V inhibitor

0.098 0.074 CID_999

CID_999
0.0240.0860.041Histamine H2 receptor agonist

0.041 0.033 CID_999

CID_999
0.0450.1150.068Nicotinic alpha4beta2 receptor antagonist

0.068 0.064 CID_999

CID_999
0.020.0930.049Glutamate (mGluR group I) agonist

0.049 0.032 CID_999

CID_999
0.040.1160.062Potassium channel intermediate-conductance Ca-activated blocker

0.062 0.038 CID_999

CID_999
0.0260.1110.042Histamine H1 receptor agonist

0.042 0.034 CID_999

CID_999
0.1160.2290.17Cardiotonic

0.17 0.152 CID_999

CID_999
Ext Pa Pi Pmax Activity Other Results ID Pa_max