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

Ext Pa Pi Pmax Activity Other Results ID Pa_max
0.7350.0020.735Neuronal nicotinic receptor antagonist

0.375 0.004 CHEMBL3544718

0.602 0.003 CHEMBL1190855

0.681 0.003 CHEMBL6200

0.063 0.051 CHEMBL3544704

0.321 0.005 CHEMBL3126023

0.11 0.02 CHEMBL3544720

0.39 0.004 CHEMBL3544719

0.369 0.004 CHEMBL578211

0.264 0.005 CHEMBL3544721

0.155 0.012 CHEMBL3544622

0.254 0.006 CHEMBL3544791

0.12 0.017 CHEMBL3544793

0.061 0.053 CHEMBL3544599

0.097 0.025 CHEMBL3544621

0.173 0.01 CHEMBL1614639

0.098 0.025 CHEMBL3544790

0.135 0.014 CHEMBL3544600

0.164 0.011 CHEMBL3544624

0.083 0.034 CHEMBL3544625

0.111 0.02 CHEMBL3544626

0.105 0.022 CHEMBL1741437

0.7310.0030.731Acetylcholine nicotinic antagonist

0.376 0.005 CHEMBL3544718

0.712 0.003 CHEMBL1190855

0.666 0.003 CHEMBL6200

0.084 0.051 CHEMBL3544704

0.331 0.006 CHEMBL3126023

0.121 0.03 CHEMBL3544720

0.4 0.005 CHEMBL3544719

0.377 0.005 CHEMBL578211

0.31 0.007 CHEMBL3544721

0.161 0.018 CHEMBL3544622

0.356 0.005 CHEMBL3544791

0.134 0.025 CHEMBL3544793

0.105 0.036 CHEMBL3544621

0.217 0.011 CHEMBL1614639

0.14 0.023 CHEMBL3544790

0.149 0.02 CHEMBL3544600

0.171 0.016 CHEMBL3544624

0.101 0.039 CHEMBL3544625

0.16 0.018 CHEMBL3544626

0.131 0.026 CHEMBL1741437

0.6930.0020.693Nicotinic receptor alpha7 subunit antagonist

0.124 0.009 CHEMBL3544718

0.515 0.002 CHEMBL1190855

0.556 0.002 CHEMBL6200

0.06 0.029 CHEMBL3544704

0.256 0.004 CHEMBL3126023

0.094 0.013 CHEMBL3544720

0.307 0.003 CHEMBL3544719

0.296 0.003 CHEMBL578211

0.134 0.008 CHEMBL3544721

0.088 0.015 CHEMBL3544622

0.222 0.004 CHEMBL3544791

0.075 0.019 CHEMBL3544793

0.057 0.032 CHEMBL3544599

0.082 0.016 CHEMBL3544621

0.151 0.006 CHEMBL1614639

0.073 0.02 CHEMBL3544790

0.068 0.023 CHEMBL3544600

0.165 0.005 CHEMBL3544624

0.051 0.041 CHEMBL3544625

0.08 0.017 CHEMBL3544626

0.086 0.015 CHEMBL1741437

0.650.0020.65Nicotinic alpha4beta2 receptor antagonist

0.437 0.003 CHEMBL3544718

0.528 0.002 CHEMBL1190855

0.631 0.002 CHEMBL6200

0.333 0.003 CHEMBL3126023

0.15 0.008 CHEMBL3544720

0.227 0.004 CHEMBL3544719

0.258 0.004 CHEMBL578211

0.134 0.012 CHEMBL3544721

0.098 0.033 CHEMBL3544622

0.177 0.005 CHEMBL3544791

0.105 0.027 CHEMBL3544793

0.083 0.047 CHEMBL3544599

0.114 0.021 CHEMBL3544621

0.18 0.005 CHEMBL1614639

0.099 0.032 CHEMBL3544790

0.104 0.028 CHEMBL3544600

0.074 0.056 CHEMBL3544623

0.114 0.021 CHEMBL3544624

0.122 0.017 CHEMBL3544625

0.141 0.01 CHEMBL3544626

0.12 0.017 CHEMBL1741437

0.6590.0180.775Analgesic

0.775 0.007 CHEMBL3544718

0.642 0.02 CHEMBL1190855

0.597 0.027 CHEMBL6200

0.343 0.112 CHEMBL3544704

0.359 0.104 CHEMBL3544719

0.377 0.095 CHEMBL578211

0.325 0.124 CHEMBL3544721

0.339 0.114 CHEMBL3544791

0.268 0.167 CHEMBL3544793

0.232 0.2 CHEMBL1614639

CHEMBL3544718
0.5720.0030.587Acetylcholine nicotinic agonist

0.18 0.01 CHEMBL3544718

0.299 0.004 CHEMBL1190855

0.587 0.002 CHEMBL6200

0.25 0.005 CHEMBL3126023

0.098 0.039 CHEMBL3544720

0.233 0.005 CHEMBL3544719

0.311 0.004 CHEMBL578211

0.132 0.022 CHEMBL3544721

0.174 0.011 CHEMBL3544791

0.174 0.011 CHEMBL3544793

0.083 0.053 CHEMBL3544621

0.188 0.009 CHEMBL1614639

0.079 0.058 CHEMBL3544600

0.087 0.048 CHEMBL3544624

0.084 0.052 CHEMBL3544625

0.075 0.063 CHEMBL3544626

CHEMBL6200
0.5590.0040.559Cholinergic antagonist

0.358 0.01 CHEMBL3544718

0.542 0.004 CHEMBL1190855

0.429 0.006 CHEMBL6200

0.361 0.01 CHEMBL3544704

0.217 0.028 CHEMBL3126023

0.132 0.063 CHEMBL3544720

0.312 0.013 CHEMBL3544719

0.347 0.01 CHEMBL578211

0.212 0.029 CHEMBL3544721

0.134 0.062 CHEMBL3544622

0.332 0.012 CHEMBL3544791

0.156 0.049 CHEMBL3559662

0.261 0.019 CHEMBL3544793

0.103 0.091 CHEMBL3544599

0.161 0.047 CHEMBL3544621

0.239 0.023 CHEMBL1614639

0.101 0.095 CHEMBL3544790

0.126 0.068 CHEMBL3544600

0.116 0.077 CHEMBL3544623

0.122 0.071 CHEMBL3544626

0.113 0.081 CHEMBL1741437

0.5570.0040.557Acetylcholine antagonist

0.267 0.017 CHEMBL3544718

0.526 0.004 CHEMBL1190855

0.429 0.006 CHEMBL6200

0.318 0.012 CHEMBL3544704

0.213 0.027 CHEMBL3126023

0.129 0.063 CHEMBL3544720

0.311 0.013 CHEMBL3544719

0.345 0.01 CHEMBL578211

0.187 0.034 CHEMBL3544721

0.12 0.07 CHEMBL3544622

0.317 0.012 CHEMBL3544791

0.144 0.053 CHEMBL3559662

0.259 0.019 CHEMBL3544793

0.102 0.09 CHEMBL3544599

0.144 0.053 CHEMBL3544621

0.236 0.023 CHEMBL1614639

0.112 0.078 CHEMBL3544600

0.111 0.079 CHEMBL3544623

0.118 0.072 CHEMBL3544626

0.107 0.083 CHEMBL1741437

0.5350.0030.535Acetylcholine agonist

0.281 0.006 CHEMBL3544718

0.387 0.004 CHEMBL1190855

0.476 0.004 CHEMBL6200

0.232 0.01 CHEMBL3126023

0.078 0.068 CHEMBL3544720

0.33 0.005 CHEMBL3544719

0.479 0.004 CHEMBL578211

0.093 0.052 CHEMBL3544721

0.337 0.005 CHEMBL3544791

0.281 0.006 CHEMBL3544793

0.122 0.036 CHEMBL3544621

0.378 0.004 CHEMBL1614639

0.107 0.042 CHEMBL3544624

0.540.0080.572Psychostimulant

0.17 0.1 CHEMBL3544718

0.489 0.012 CHEMBL1190855

0.472 0.014 CHEMBL6200

0.543 0.008 CHEMBL3544704

0.289 0.046 CHEMBL3126023

0.2 0.08 CHEMBL3544720

0.419 0.019 CHEMBL3544719

0.572 0.007 CHEMBL578211

0.278 0.049 CHEMBL3544721

0.142 0.123 CHEMBL3544622

0.513 0.01 CHEMBL3544791

0.399 0.023 CHEMBL3559662

0.381 0.026 CHEMBL3544793

0.234 0.065 CHEMBL3544599

0.324 0.037 CHEMBL3544621

0.411 0.021 CHEMBL1614639

0.187 0.088 CHEMBL3544790

0.431 0.018 CHEMBL3544598

0.202 0.079 CHEMBL3544623

0.222 0.069 CHEMBL3544624

0.238 0.063 CHEMBL3544625

0.315 0.039 CHEMBL3544626

0.167 0.103 CHEMBL1741437

CHEMBL578211
0.5360.0150.619Nootropic

0.37 0.047 CHEMBL3544718

0.619 0.009 CHEMBL1190855

0.528 0.016 CHEMBL6200

0.222 0.132 CHEMBL3126023

0.458 0.026 CHEMBL3544719

0.532 0.016 CHEMBL578211

0.613 0.01 CHEMBL3544791

0.306 0.072 CHEMBL3544793

0.21 0.145 CHEMBL1614639

0.258 0.101 CHEMBL3544626

0.243 0.114 CHEMBL1741437

CHEMBL1190855
0.5370.0220.5425 Hydroxytryptamine release stimulant

0.542 0.021 CHEMBL1190855

0.452 0.036 CHEMBL6200

0.295 0.071 CHEMBL3126023

0.247 0.091 CHEMBL3544720

0.195 0.126 CHEMBL3544719

0.19 0.13 CHEMBL578211

0.316 0.065 CHEMBL3544721

0.193 0.127 CHEMBL3544791

0.179 0.142 CHEMBL1614639

0.195 0.126 CHEMBL3544598

0.189 0.132 CHEMBL3544624

0.175 0.147 CHEMBL3544625

0.283 0.076 CHEMBL3544626

0.273 0.079 CHEMBL1741437

CHEMBL1190855
0.5290.0230.669Vasodilator, peripheral

0.39 0.058 CHEMBL1190855

0.345 0.076 CHEMBL6200

0.601 0.016 CHEMBL3544704

0.283 0.106 CHEMBL3126023

0.299 0.098 CHEMBL3544720

0.444 0.042 CHEMBL3544719

0.463 0.037 CHEMBL578211

0.517 0.025 CHEMBL3544721

0.368 0.066 CHEMBL3544622

0.316 0.089 CHEMBL3544791

0.479 0.032 CHEMBL3559662

0.566 0.019 CHEMBL3544793

0.323 0.086 CHEMBL3544599

0.443 0.042 CHEMBL3544621

0.468 0.035 CHEMBL1614639

0.669 0.009 CHEMBL3544790

0.417 0.05 CHEMBL3544600

0.468 0.035 CHEMBL3544598

0.608 0.015 CHEMBL3544623

0.293 0.101 CHEMBL3544624

0.627 0.013 CHEMBL3544625

0.613 0.015 CHEMBL3544626

0.472 0.034 CHEMBL1741437

CHEMBL3544790
0.4950.010.516Sigma receptor agonist

0.516 0.008 CHEMBL1190855

0.158 0.08 CHEMBL3544704

0.158 0.08 CHEMBL578211

0.184 0.067 CHEMBL3544791

0.138 0.094 CHEMBL3544793

0.237 0.051 CHEMBL3544625

CHEMBL1190855
0.4830.0020.506Nicotinic neuronal receptor agonist

0.115 0.01 CHEMBL3544718

0.219 0.004 CHEMBL1190855

0.506 0.002 CHEMBL6200

0.164 0.005 CHEMBL3126023

0.053 0.042 CHEMBL3544720

0.156 0.005 CHEMBL3544719

0.228 0.004 CHEMBL578211

0.067 0.03 CHEMBL3544721

0.109 0.011 CHEMBL3544791

0.116 0.009 CHEMBL3544793

0.108 0.011 CHEMBL1614639

CHEMBL6200
0.4780.0170.509Potassium channel (Voltage-sensitive) blocker

0.217 0.085 CHEMBL3544718

0.509 0.014 CHEMBL1190855

0.382 0.03 CHEMBL6200

0.154 0.133 CHEMBL3544719

0.286 0.054 CHEMBL578211

0.313 0.046 CHEMBL3544791

CHEMBL1190855
0.4760.0180.54HERG channel blocker

0.245 0.068 CHEMBL3544718

0.54 0.012 CHEMBL1190855

0.381 0.031 CHEMBL6200

0.249 0.066 CHEMBL578211

0.305 0.048 CHEMBL3544791

0.144 0.136 CHEMBL3544793

CHEMBL1190855
0.4310.0030.431Nicotinic receptor alpha3 subunit antagonist

0.062 0.018 CHEMBL3544718

0.366 0.003 CHEMBL1190855

0.378 0.003 CHEMBL6200

0.125 0.008 CHEMBL3126023

0.044 0.03 CHEMBL3544720

0.168 0.006 CHEMBL3544719

0.18 0.005 CHEMBL578211

0.04 0.035 CHEMBL3544721

0.068 0.016 CHEMBL3544622

0.141 0.007 CHEMBL3544791

0.051 0.024 CHEMBL3544793

0.045 0.029 CHEMBL3544621

0.065 0.017 CHEMBL1614639

0.039 0.037 CHEMBL3544600

0.054 0.022 CHEMBL3544626

0.041 0.034 CHEMBL1741437

0.4730.0470.53Ca2+/calmodulin-dependent protein kinase kinase A inhibitor

0.365 0.135 CHEMBL3544718

0.399 0.102 CHEMBL1190855

0.504 0.032 CHEMBL6200

0.403 0.098 CHEMBL3126023

0.46 0.055 CHEMBL3544720

0.515 0.027 CHEMBL3544719

0.502 0.033 CHEMBL578211

0.53 0.022 CHEMBL3544721

0.492 0.037 CHEMBL3544622

0.431 0.075 CHEMBL3544791

0.351 0.149 CHEMBL3544793

0.489 0.038 CHEMBL3544599

0.428 0.077 CHEMBL3544621

0.332 0.171 CHEMBL1614639

0.416 0.087 CHEMBL3544790

0.5 0.034 CHEMBL3544600

0.393 0.107 CHEMBL3544623

0.411 0.091 CHEMBL3544624

0.401 0.099 CHEMBL3544625

0.427 0.078 CHEMBL3544626

0.488 0.039 CHEMBL1741437

CHEMBL3544721
0.4490.0310.574Spasmolytic

0.355 0.051 CHEMBL3544718

0.366 0.048 CHEMBL1190855

0.275 0.08 CHEMBL6200

0.54 0.019 CHEMBL3544704

0.165 0.15 CHEMBL3126023

0.172 0.143 CHEMBL3544719

0.274 0.081 CHEMBL578211

0.393 0.041 CHEMBL3544721

0.198 0.121 CHEMBL3544622

0.205 0.115 CHEMBL3544791

0.159 0.155 CHEMBL3559662

0.255 0.089 CHEMBL3544621

0.334 0.058 CHEMBL1614639

0.306 0.068 CHEMBL3544790

0.236 0.097 CHEMBL3544600

0.574 0.016 CHEMBL3544598

0.399 0.04 CHEMBL3544623

0.196 0.123 CHEMBL3544624

0.241 0.095 CHEMBL3544625

0.288 0.075 CHEMBL3544626

0.248 0.092 CHEMBL1741437

CHEMBL3544598
0.4570.0470.698Histamine release inhibitor

0.292 0.128 CHEMBL1190855

0.274 0.139 CHEMBL6200

0.382 0.085 CHEMBL3544704

0.347 0.101 CHEMBL3126023

0.225 0.176 CHEMBL3544720

0.367 0.092 CHEMBL3544719

0.37 0.091 CHEMBL578211

0.448 0.051 CHEMBL3544721

0.453 0.048 CHEMBL3544622

0.207 0.194 CHEMBL3544599

0.229 0.172 CHEMBL3544621

0.35 0.1 CHEMBL1614639

0.642 0.007 CHEMBL3544790

0.494 0.031 CHEMBL3544600

0.566 0.014 CHEMBL3544598

0.528 0.021 CHEMBL3544623

0.472 0.04 CHEMBL3544624

0.503 0.028 CHEMBL3544625

0.698 0.005 CHEMBL3544626

0.644 0.007 CHEMBL1741437

CHEMBL3544626
0.3870.0050.387Dopamine agonist

0.351 0.005 CHEMBL1190855

0.13 0.018 CHEMBL6200

0.07 0.044 CHEMBL3544704

0.076 0.04 CHEMBL3126023

0.072 0.043 CHEMBL3544719

0.103 0.026 CHEMBL578211

0.086 0.034 CHEMBL3544791

0.175 0.012 CHEMBL3544793

0.3860.0090.406NOS3 expression enhancer

0.154 0.068 CHEMBL3544718

0.293 0.019 CHEMBL1190855

0.271 0.022 CHEMBL6200

0.297 0.018 CHEMBL3544704

0.299 0.018 CHEMBL3126023

0.321 0.015 CHEMBL3544719

0.406 0.008 CHEMBL578211

0.315 0.016 CHEMBL3544791

0.297 0.018 CHEMBL3559662

0.244 0.028 CHEMBL3544793

0.135 0.09 CHEMBL3544599

0.331 0.014 CHEMBL3544621

0.299 0.018 CHEMBL1614639

0.137 0.087 CHEMBL3544790

0.357 0.011 CHEMBL3544598

0.131 0.095 CHEMBL3544623

0.13 0.098 CHEMBL3544624

0.37 0.01 CHEMBL3544625

0.329 0.014 CHEMBL3544626

0.261 0.024 CHEMBL1741437

CHEMBL578211
0.3820.0060.394Acetylcholine M1 receptor antagonist

0.217 0.035 CHEMBL3544718

0.374 0.007 CHEMBL1190855

0.247 0.026 CHEMBL6200

0.394 0.005 CHEMBL3544704

0.188 0.048 CHEMBL3126023

0.143 0.081 CHEMBL3544720

0.164 0.063 CHEMBL3544719

0.283 0.018 CHEMBL578211

0.158 0.068 CHEMBL3544721

0.277 0.019 CHEMBL3544791

0.272 0.02 CHEMBL3559662

0.171 0.057 CHEMBL3544793

0.123 0.104 CHEMBL3544599

0.145 0.079 CHEMBL3544621

0.24 0.028 CHEMBL1614639

0.151 0.074 CHEMBL3544623

CHEMBL3544704
0.3770.0030.377Nicotinic alpha7 receptor agonist

0.098 0.011 CHEMBL3544718

0.179 0.004 CHEMBL1190855

0.177 0.004 CHEMBL6200

0.129 0.005 CHEMBL3126023

0.095 0.012 CHEMBL3544719

0.177 0.004 CHEMBL578211

0.102 0.01 CHEMBL3544791

0.089 0.014 CHEMBL3544793

0.094 0.012 CHEMBL1614639

0.3690.0020.369Nicotinic alpha3beta2 receptor antagonist

0.233 0.003 CHEMBL3544718

0.192 0.003 CHEMBL1190855

0.366 0.002 CHEMBL6200

0.155 0.004 CHEMBL3126023

0.082 0.012 CHEMBL3544720

0.133 0.004 CHEMBL3544719

0.135 0.004 CHEMBL578211

0.087 0.01 CHEMBL3544721

0.079 0.013 CHEMBL3544791

0.061 0.025 CHEMBL3544793

0.06 0.026 CHEMBL3544621

0.126 0.005 CHEMBL1614639

0.056 0.031 CHEMBL3544790

0.06 0.026 CHEMBL3544600

0.084 0.011 CHEMBL3544624

0.07 0.018 CHEMBL3544626

0.066 0.021 CHEMBL1741437

0.3720.0060.3825 Hydroxytryptamine 1E antagonist

0.211 0.118 CHEMBL3544718

0.382 0.005 CHEMBL1190855

0.264 0.06 CHEMBL6200

0.287 0.039 CHEMBL3126023

0.202 0.129 CHEMBL3544720

0.203 0.127 CHEMBL3544719

0.269 0.055 CHEMBL578211

0.281 0.044 CHEMBL3544721

0.277 0.048 CHEMBL3544791

0.215 0.113 CHEMBL3544793

0.173 0.163 CHEMBL3544600

CHEMBL1190855
0.3620.0030.396Nicotinic receptor alpha4 subunit antagonist

0.144 0.005 CHEMBL3544718

0.318 0.003 CHEMBL1190855

0.396 0.002 CHEMBL6200

0.079 0.013 CHEMBL3544704

0.247 0.003 CHEMBL3126023

0.057 0.024 CHEMBL3544720

0.237 0.003 CHEMBL3544719

0.219 0.004 CHEMBL578211

0.066 0.018 CHEMBL3544721

0.049 0.034 CHEMBL3544622

0.18 0.004 CHEMBL3544791

0.052 0.03 CHEMBL3559662

0.138 0.005 CHEMBL3544793

0.12 0.005 CHEMBL3544621

0.135 0.005 CHEMBL1614639

0.049 0.034 CHEMBL3544600

0.051 0.031 CHEMBL3544598

0.046 0.042 CHEMBL3544624

0.047 0.04 CHEMBL3544625

0.054 0.027 CHEMBL3544626

0.054 0.027 CHEMBL1741437

CHEMBL6200
0.4090.0530.411MAP kinase kinase 6 inhibitor

0.3 0.135 CHEMBL3544718

0.411 0.052 CHEMBL6200

0.266 0.17 CHEMBL3544704

0.331 0.107 CHEMBL3126023

0.396 0.061 CHEMBL3544720

0.353 0.09 CHEMBL3544719

0.338 0.102 CHEMBL578211

0.275 0.16 CHEMBL3544793

0.328 0.11 CHEMBL3544599

0.292 0.144 CHEMBL1614639

0.285 0.15 CHEMBL3544624

0.252 0.188 CHEMBL3544626

0.365 0.081 CHEMBL1741437

CHEMBL6200
0.3810.0260.384Potassium channel blocker

0.384 0.025 CHEMBL1190855

0.311 0.043 CHEMBL6200

0.298 0.047 CHEMBL578211

0.15 0.135 CHEMBL3544721

0.298 0.047 CHEMBL3544791

CHEMBL1190855
0.3660.0210.4035 Hydroxytryptamine uptake stimulant

0.252 0.079 CHEMBL3544718

0.359 0.023 CHEMBL1190855

0.395 0.015 CHEMBL6200

0.37 0.02 CHEMBL3126023

0.236 0.096 CHEMBL3544720

0.302 0.044 CHEMBL3544719

0.326 0.033 CHEMBL578211

0.284 0.054 CHEMBL3544721

0.278 0.058 CHEMBL3544622

0.32 0.036 CHEMBL3544791

0.244 0.086 CHEMBL3544793

0.211 0.131 CHEMBL3544599

0.199 0.155 CHEMBL3544621

0.323 0.035 CHEMBL1614639

0.403 0.014 CHEMBL3544790

0.212 0.13 CHEMBL3544600

0.329 0.032 CHEMBL3544623

0.299 0.045 CHEMBL3544624

0.273 0.061 CHEMBL3544625

0.391 0.016 CHEMBL3544626

0.346 0.027 CHEMBL1741437

CHEMBL3544790
0.3460.0050.4355 Hydroxytryptamine 1F antagonist

0.435 0.004 CHEMBL1190855

0.064 0.055 CHEMBL3126023

0.152 0.016 CHEMBL578211

0.073 0.047 CHEMBL3544721

0.208 0.01 CHEMBL3544791

0.069 0.05 CHEMBL3544793

CHEMBL1190855
0.3540.0130.506Cholinergic

0.428 0.008 CHEMBL3544718

0.506 0.005 CHEMBL1190855

0.289 0.02 CHEMBL6200

0.145 0.081 CHEMBL3544719

0.278 0.022 CHEMBL578211

0.206 0.044 CHEMBL3544721

0.418 0.009 CHEMBL3544791

0.212 0.041 CHEMBL3544793

0.183 0.055 CHEMBL1614639

CHEMBL1190855
0.370.0380.371Calcium channel activator

0.308 0.084 CHEMBL1190855

0.344 0.054 CHEMBL6200

0.299 0.093 CHEMBL3544704

0.278 0.115 CHEMBL3126023

0.368 0.039 CHEMBL3544719

0.352 0.048 CHEMBL578211

0.331 0.063 CHEMBL3544721

0.29 0.102 CHEMBL3544791

0.214 0.193 CHEMBL3559662

0.25 0.147 CHEMBL3544793

0.227 0.176 CHEMBL3544599

0.283 0.109 CHEMBL3544621

0.254 0.143 CHEMBL1614639

0.258 0.138 CHEMBL3544790

0.315 0.077 CHEMBL3544623

0.336 0.059 CHEMBL3544624

0.295 0.097 CHEMBL3544625

0.326 0.068 CHEMBL3544626

0.371 0.037 CHEMBL1741437

CHEMBL1741437
0.3290.0040.329Acetylcholine M4 receptor antagonist

0.152 0.01 CHEMBL3544718

0.222 0.005 CHEMBL1190855

0.12 0.018 CHEMBL6200

0.114 0.02 CHEMBL3126023

0.1 0.028 CHEMBL3544720

0.099 0.029 CHEMBL3544719

0.174 0.008 CHEMBL578211

0.083 0.044 CHEMBL3544721

0.125 0.016 CHEMBL3544791

0.087 0.04 CHEMBL3544793

0.084 0.042 CHEMBL3544599

0.088 0.038 CHEMBL1614639

0.3150.0040.315Acetylcholine muscarinic agonist

0.169 0.008 CHEMBL3544718

0.3 0.004 CHEMBL1190855

0.182 0.008 CHEMBL6200

0.102 0.017 CHEMBL3126023

0.129 0.013 CHEMBL3544719

0.288 0.004 CHEMBL578211

0.266 0.004 CHEMBL3544791

0.147 0.01 CHEMBL3544793

0.246 0.005 CHEMBL1614639

0.051 0.042 CHEMBL3544624

0.3780.0710.47GABA C receptor rho-3 antagonist

0.224 0.18 CHEMBL3544718

0.364 0.079 CHEMBL1190855

0.368 0.077 CHEMBL6200

0.374 0.074 CHEMBL3126023

0.372 0.075 CHEMBL3544720

0.369 0.076 CHEMBL3544719

0.379 0.071 CHEMBL578211

0.456 0.04 CHEMBL3544721

0.379 0.071 CHEMBL3544622

0.365 0.078 CHEMBL3544791

0.254 0.151 CHEMBL3544793

0.373 0.074 CHEMBL3544599

0.261 0.145 CHEMBL1614639

0.404 0.06 CHEMBL3544790

0.345 0.088 CHEMBL3544600

0.335 0.094 CHEMBL3544623

0.315 0.106 CHEMBL3544624

0.432 0.048 CHEMBL3544625

0.41 0.057 CHEMBL3544626

0.47 0.035 CHEMBL1741437

CHEMBL1741437
0.3030.0040.375CYP2A6 inhibitor

0.137 0.02 CHEMBL3544718

0.17 0.012 CHEMBL1190855

0.319 0.004 CHEMBL6200

0.251 0.004 CHEMBL3126023

0.1 0.036 CHEMBL3544720

0.19 0.009 CHEMBL3544719

0.194 0.008 CHEMBL578211

0.272 0.004 CHEMBL3544721

0.192 0.009 CHEMBL3544622

0.096 0.038 CHEMBL3544791

0.068 0.061 CHEMBL3544599

0.072 0.056 CHEMBL3544621

0.113 0.03 CHEMBL1614639

0.178 0.01 CHEMBL3544790

0.166 0.013 CHEMBL3544600

0.101 0.035 CHEMBL3544623

0.375 0.003 CHEMBL3544624

0.15 0.016 CHEMBL3544625

0.214 0.006 CHEMBL3544626

0.202 0.007 CHEMBL1741437

CHEMBL3544624
0.3320.0510.411Hypoxia-inducible factor 1 alpha inhibitor

0.292 0.069 CHEMBL1190855

0.205 0.146 CHEMBL6200

0.411 0.027 CHEMBL3544704

0.18 0.178 CHEMBL3126023

0.189 0.165 CHEMBL3544720

0.262 0.09 CHEMBL578211

0.232 0.117 CHEMBL3544791

0.213 0.137 CHEMBL3559662

0.283 0.074 CHEMBL1614639

0.25 0.1 CHEMBL3544790

0.332 0.051 CHEMBL3544598

0.268 0.085 CHEMBL3544623

0.271 0.083 CHEMBL3544624

0.212 0.138 CHEMBL3544625

0.227 0.122 CHEMBL3544626

0.238 0.111 CHEMBL1741437

CHEMBL3544704
0.2790.0010.361Nicotinic alpha3beta4 receptor agonist

0.077 0.003 CHEMBL3544718

0.122 0.002 CHEMBL1190855

0.361 0.001 CHEMBL6200

0.14 0.002 CHEMBL3126023

0.052 0.005 CHEMBL3544720

0.134 0.002 CHEMBL3544719

0.119 0.002 CHEMBL578211

0.027 0.025 CHEMBL3544622

0.061 0.004 CHEMBL3544791

0.046 0.007 CHEMBL3544793

0.034 0.015 CHEMBL3544599

0.052 0.005 CHEMBL3544621

0.071 0.003 CHEMBL1614639

0.034 0.016 CHEMBL3544624

0.031 0.019 CHEMBL1741437

CHEMBL6200
0.2840.0060.3875 Hydroxytryptamine 7 antagonist

0.387 0.005 CHEMBL1190855

0.07 0.037 CHEMBL3544791

CHEMBL1190855
0.2750.0010.275Nicotinic alpha4beta2 receptor agonist

0.061 0.004 CHEMBL3544718

0.112 0.002 CHEMBL1190855

0.258 0.001 CHEMBL6200

0.114 0.002 CHEMBL3126023

0.042 0.007 CHEMBL3544720

0.073 0.003 CHEMBL3544719

0.093 0.003 CHEMBL578211

0.046 0.005 CHEMBL3544721

0.046 0.005 CHEMBL3544791

0.053 0.004 CHEMBL3544793

0.038 0.009 CHEMBL3544621

0.041 0.007 CHEMBL1614639

0.03 0.017 CHEMBL3544600

0.036 0.011 CHEMBL3544625

0.032 0.015 CHEMBL1741437

0.2760.0040.276Acetylcholine M1 receptor agonist

0.139 0.008 CHEMBL3544718

0.272 0.004 CHEMBL1190855

0.149 0.007 CHEMBL6200

0.083 0.015 CHEMBL3126023

0.1 0.013 CHEMBL3544719

0.239 0.004 CHEMBL578211

0.234 0.004 CHEMBL3544791

0.124 0.01 CHEMBL3544793

0.094 0.013 CHEMBL1614639

0.038 0.034 CHEMBL3544624

0.2870.0150.35 Hydroxytryptamine 2B antagonist

0.099 0.084 CHEMBL3544718

0.3 0.014 CHEMBL1190855

0.131 0.051 CHEMBL6200

0.14 0.046 CHEMBL3126023

0.099 0.085 CHEMBL3544720

0.141 0.045 CHEMBL578211

0.151 0.041 CHEMBL3544721

0.147 0.042 CHEMBL3544791

CHEMBL1190855
0.30.0420.533Cyclic AMP phosphodiesterase inhibitor

0.169 0.123 CHEMBL1190855

0.188 0.103 CHEMBL6200

0.533 0.005 CHEMBL3544704

0.182 0.109 CHEMBL3126023

0.326 0.033 CHEMBL3544719

0.284 0.048 CHEMBL578211

0.155 0.143 CHEMBL3544721

0.167 0.126 CHEMBL3544622

0.159 0.137 CHEMBL3544791

0.301 0.041 CHEMBL3559662

0.177 0.114 CHEMBL3544599

0.207 0.089 CHEMBL1614639

0.254 0.062 CHEMBL3544790

0.169 0.124 CHEMBL3544600

0.329 0.031 CHEMBL3544598

0.178 0.113 CHEMBL3544623

0.27 0.054 CHEMBL3544624

0.226 0.076 CHEMBL3544626

0.293 0.045 CHEMBL1741437

CHEMBL3544704
0.2630.0060.291Opioid kappa receptor antagonist

0.291 0.005 CHEMBL1190855

0.074 0.068 CHEMBL6200

0.09 0.046 CHEMBL3544704

0.075 0.066 CHEMBL3544791

0.079 0.059 CHEMBL1614639

0.073 0.07 CHEMBL3544624

CHEMBL1190855
0.260.0040.319Prolactin inhibitor

0.092 0.064 CHEMBL3544718

0.319 0.003 CHEMBL1190855

0.198 0.009 CHEMBL6200

0.169 0.015 CHEMBL3126023

0.148 0.023 CHEMBL3544720

0.099 0.057 CHEMBL3544719

0.154 0.021 CHEMBL578211

0.204 0.008 CHEMBL3544791

0.121 0.038 CHEMBL3544793

0.091 0.066 CHEMBL3544599

0.111 0.045 CHEMBL1614639

0.104 0.051 CHEMBL3544790

0.088 0.069 CHEMBL3544623

0.113 0.044 CHEMBL3544625

0.159 0.019 CHEMBL3544626

0.101 0.054 CHEMBL1741437

CHEMBL1190855
0.290.0380.359Tyrosine 3 hydroxylase inhibitor

0.19 0.155 CHEMBL3544718

0.31 0.029 CHEMBL1190855

0.272 0.05 CHEMBL6200

0.258 0.061 CHEMBL3126023

0.231 0.089 CHEMBL3544720

0.21 0.119 CHEMBL3544719

0.234 0.085 CHEMBL578211

0.2 0.136 CHEMBL3544721

0.235 0.084 CHEMBL3544622

0.251 0.067 CHEMBL3544791

0.225 0.097 CHEMBL3544793

0.183 0.17 CHEMBL3544599

0.184 0.167 CHEMBL3544621

0.206 0.125 CHEMBL1614639

0.33 0.021 CHEMBL3544790

0.187 0.161 CHEMBL3544600

0.259 0.06 CHEMBL3544623

0.197 0.141 CHEMBL3544624

0.303 0.032 CHEMBL3544625

0.359 0.014 CHEMBL3544626

0.32 0.025 CHEMBL1741437

CHEMBL3544626
0.2870.0360.381Anesthetic general

0.233 0.058 CHEMBL1190855

0.159 0.104 CHEMBL6200

0.138 0.128 CHEMBL3544704

0.156 0.107 CHEMBL3126023

0.151 0.113 CHEMBL3544719

0.198 0.075 CHEMBL578211

0.154 0.109 CHEMBL3544721

0.144 0.12 CHEMBL3544622

0.15 0.113 CHEMBL3544791

0.254 0.049 CHEMBL1614639

0.271 0.042 CHEMBL3544790

0.277 0.039 CHEMBL3544598

0.256 0.048 CHEMBL3544623

0.224 0.062 CHEMBL3544625

0.336 0.026 CHEMBL3544626

0.381 0.019 CHEMBL1741437

CHEMBL1741437
0.2590.0140.259Cyclin-dependent kinase 8 inhibitor

0.135 0.097 CHEMBL3544718

0.191 0.042 CHEMBL1190855

0.215 0.027 CHEMBL6200

0.212 0.029 CHEMBL3126023

0.154 0.075 CHEMBL3544720

0.204 0.033 CHEMBL3544719

0.236 0.019 CHEMBL578211

0.145 0.084 CHEMBL3544721

0.156 0.074 CHEMBL3544622

0.174 0.057 CHEMBL3544791

0.137 0.094 CHEMBL3544793

0.133 0.098 CHEMBL3544599

0.129 0.104 CHEMBL3544621

0.175 0.056 CHEMBL1614639

0.129 0.104 CHEMBL3544600

0.260.0190.26Activin receptor-like kinase 2 inhibitor

0.124 0.092 CHEMBL3544718

0.165 0.056 CHEMBL1190855

0.235 0.024 CHEMBL6200

0.204 0.035 CHEMBL3126023

0.124 0.091 CHEMBL3544720

0.203 0.036 CHEMBL3544719

0.217 0.03 CHEMBL578211

0.133 0.082 CHEMBL3544791

0.122 0.093 CHEMBL1614639

0.2530.0140.253Acetylcholine muscarinic antagonist

0.139 0.051 CHEMBL3544718

0.239 0.016 CHEMBL1190855

0.137 0.053 CHEMBL6200

0.25 0.014 CHEMBL3544704

0.106 0.084 CHEMBL3126023

0.101 0.09 CHEMBL3544719

0.172 0.033 CHEMBL578211

0.117 0.07 CHEMBL3544721

0.161 0.038 CHEMBL3544791

0.133 0.056 CHEMBL3559662

0.188 0.028 CHEMBL3544793

0.132 0.056 CHEMBL1614639

0.2390.0010.253Nicotinic alpha4 receptor agonist

0.038 0.004 CHEMBL3544718

0.104 0.003 CHEMBL1190855

0.253 0.001 CHEMBL6200

0.111 0.003 CHEMBL3126023

0.016 0.011 CHEMBL3544720

0.061 0.003 CHEMBL3544719

0.078 0.003 CHEMBL578211

0.019 0.008 CHEMBL3544721

0.02 0.007 CHEMBL3544791

0.024 0.005 CHEMBL3544793

0.017 0.011 CHEMBL3544621

0.017 0.01 CHEMBL1614639

0.015 0.014 CHEMBL1741437

CHEMBL6200
0.2910.0540.659Superoxide dismutase inhibitor

0.21 0.106 CHEMBL3544718

0.201 0.117 CHEMBL1190855

0.48 0.015 CHEMBL6200

0.252 0.073 CHEMBL3126023

0.207 0.11 CHEMBL3544720

0.27 0.063 CHEMBL3544719

0.224 0.094 CHEMBL578211

0.401 0.027 CHEMBL3544721

0.659 0.005 CHEMBL3544622

0.186 0.134 CHEMBL3544621

0.191 0.127 CHEMBL1614639

0.542 0.01 CHEMBL3544790

0.282 0.057 CHEMBL3544600

0.288 0.055 CHEMBL3544623

0.196 0.122 CHEMBL3544624

0.532 0.01 CHEMBL3544625

0.43 0.022 CHEMBL3544626

0.485 0.014 CHEMBL1741437

CHEMBL3544622
0.240.0060.2415 Hydroxytryptamine 3A agonist

0.124 0.052 CHEMBL3544718

0.241 0.006 CHEMBL1190855

0.207 0.013 CHEMBL6200

0.172 0.025 CHEMBL3126023

0.124 0.053 CHEMBL3544720

0.207 0.013 CHEMBL3544719

0.179 0.022 CHEMBL578211

0.098 0.078 CHEMBL3544721

0.18 0.022 CHEMBL3544791

0.117 0.058 CHEMBL3544793

CHEMBL1190855
0.2980.0660.371Ca2+/calmodulin-dependent kinase II alpha inhibitor

0.371 0.029 CHEMBL1190855

0.211 0.145 CHEMBL6200

0.201 0.156 CHEMBL3544704

0.23 0.126 CHEMBL3126023

0.289 0.072 CHEMBL3544720

0.259 0.098 CHEMBL578211

0.231 0.124 CHEMBL3544721

0.264 0.093 CHEMBL3544622

0.332 0.044 CHEMBL3544791

0.253 0.104 CHEMBL3544599

0.225 0.131 CHEMBL1614639

CHEMBL1190855
0.2550.0240.3795 Hydroxytryptamine antagonist

0.379 0.013 CHEMBL1190855

0.14 0.054 CHEMBL6200

0.172 0.041 CHEMBL3126023

0.111 0.07 CHEMBL578211

0.13 0.059 CHEMBL3544721

0.175 0.041 CHEMBL3544791

CHEMBL1190855
0.2320.0050.232Dopamine D2 agonist

0.228 0.005 CHEMBL1190855

0.044 0.031 CHEMBL3544704

0.039 0.036 CHEMBL3544719

0.053 0.025 CHEMBL578211

0.049 0.027 CHEMBL3544791

0.2420.0160.242Alpha 2b adrenoreceptor antagonist

0.24 0.016 CHEMBL1190855

0.15 0.039 CHEMBL6200

0.102 0.073 CHEMBL578211

0.195 0.025 CHEMBL3544721

0.101 0.074 CHEMBL3544791

0.3610.1370.516Caspase 9 stimulant

0.286 0.209 CHEMBL1190855

0.348 0.147 CHEMBL6200

0.404 0.109 CHEMBL3544704

0.315 0.178 CHEMBL3126023

0.346 0.148 CHEMBL3544720

0.371 0.13 CHEMBL3544719

0.356 0.141 CHEMBL578211

0.332 0.161 CHEMBL3544721

0.281 0.215 CHEMBL3544622

0.282 0.214 CHEMBL3544791

0.438 0.089 CHEMBL3559662

0.342 0.152 CHEMBL3544599

0.323 0.17 CHEMBL1614639

0.491 0.063 CHEMBL3544790

0.313 0.18 CHEMBL3544600

0.386 0.12 CHEMBL3544598

0.477 0.069 CHEMBL3544623

0.449 0.084 CHEMBL3544624

0.486 0.066 CHEMBL3544625

0.516 0.054 CHEMBL3544626

0.486 0.066 CHEMBL1741437

CHEMBL3544626
0.2260.0040.306Acetylcholine release stimulant

0.154 0.014 CHEMBL3544718

0.156 0.013 CHEMBL1190855

0.172 0.008 CHEMBL6200

0.178 0.006 CHEMBL3126023

0.136 0.027 CHEMBL3544720

0.188 0.005 CHEMBL3544719

0.306 0.003 CHEMBL578211

0.179 0.006 CHEMBL3544721

0.206 0.004 CHEMBL3544622

0.183 0.005 CHEMBL3544791

0.148 0.018 CHEMBL3544793

0.158 0.012 CHEMBL3544599

0.15 0.016 CHEMBL3544621

0.149 0.017 CHEMBL1614639

0.15 0.016 CHEMBL3544790

0.17 0.008 CHEMBL3544600

0.181 0.006 CHEMBL3544598

0.143 0.021 CHEMBL3544623

0.122 0.045 CHEMBL3544624

0.141 0.023 CHEMBL3544625

0.198 0.005 CHEMBL3544626

0.16 0.011 CHEMBL1741437

CHEMBL578211
0.220.0180.233Antihistaminic

0.129 0.039 CHEMBL3544718

0.173 0.026 CHEMBL1190855

0.17 0.027 CHEMBL6200

0.233 0.016 CHEMBL3544721

0.09 0.065 CHEMBL3544793

0.111 0.047 CHEMBL3544600

CHEMBL3544721
0.2040.0050.245Dopamine D5 antagonist

0.131 0.007 CHEMBL3544718

0.245 0.004 CHEMBL1190855

0.054 0.023 CHEMBL6200

0.047 0.027 CHEMBL3126023

0.078 0.012 CHEMBL578211

0.106 0.009 CHEMBL3544791

0.053 0.023 CHEMBL3544793

CHEMBL1190855
0.2610.0640.569Vasodilator

0.216 0.092 CHEMBL1190855

0.174 0.128 CHEMBL6200

0.39 0.025 CHEMBL3544704

0.201 0.104 CHEMBL3544719

0.181 0.12 CHEMBL578211

0.263 0.062 CHEMBL3544721

0.18 0.122 CHEMBL3544622

0.224 0.087 CHEMBL3559662

0.569 0.007 CHEMBL3544793

0.449 0.016 CHEMBL1614639

0.301 0.048 CHEMBL3544790

0.166 0.136 CHEMBL3544600

0.506 0.012 CHEMBL3544598

0.283 0.054 CHEMBL3544623

0.36 0.031 CHEMBL3544624

0.224 0.086 CHEMBL3544625

0.29 0.052 CHEMBL3544626

0.209 0.098 CHEMBL1741437

CHEMBL3544793
0.2020.0070.202Acetylcholine M2 receptor antagonist

0.076 0.032 CHEMBL3544718

0.138 0.013 CHEMBL1190855

0.066 0.04 CHEMBL6200

0.06 0.045 CHEMBL3126023

0.054 0.051 CHEMBL3544720

0.127 0.015 CHEMBL578211

0.066 0.039 CHEMBL3544721

0.083 0.028 CHEMBL3544791

0.079 0.03 CHEMBL3544793

0.058 0.046 CHEMBL1614639

0.210.0160.215 Hydroxytryptamine 2C antagonist

0.205 0.016 CHEMBL1190855

0.099 0.046 CHEMBL6200

0.1 0.045 CHEMBL3126023

0.137 0.03 CHEMBL3544721

0.1940.0060.194Histamine N-methyltransferase inhibitor

0.077 0.071 CHEMBL3544718

0.165 0.01 CHEMBL1190855

0.128 0.024 CHEMBL6200

0.145 0.016 CHEMBL3544704

0.12 0.03 CHEMBL3126023

0.122 0.028 CHEMBL3544720

0.096 0.05 CHEMBL578211

0.168 0.009 CHEMBL3544721

0.137 0.02 CHEMBL3544622

0.08 0.067 CHEMBL1614639

0.106 0.041 CHEMBL3544790

0.112 0.036 CHEMBL3544600

0.131 0.023 CHEMBL3544626

0.116 0.032 CHEMBL1741437

0.2060.0180.225Histamine antagonist

0.121 0.038 CHEMBL3544718

0.161 0.027 CHEMBL1190855

0.163 0.026 CHEMBL6200

0.225 0.016 CHEMBL3544721

0.079 0.064 CHEMBL3544793

0.101 0.047 CHEMBL3544600

CHEMBL3544721
0.2440.0590.338Anticonvulsant

0.211 0.075 CHEMBL1190855

0.218 0.071 CHEMBL6200

0.142 0.139 CHEMBL3544704

0.194 0.087 CHEMBL3544719

0.201 0.082 CHEMBL578211

0.321 0.035 CHEMBL3544721

0.338 0.031 CHEMBL3544622

0.176 0.102 CHEMBL3544791

0.322 0.035 CHEMBL3544793

0.295 0.042 CHEMBL3544621

0.317 0.036 CHEMBL3544790

0.334 0.032 CHEMBL3544600

0.187 0.093 CHEMBL3544626

0.19 0.091 CHEMBL1741437

CHEMBL3544622
0.1870.0050.187Acetylcholine M5 receptor antagonist

0.081 0.024 CHEMBL3544718

0.134 0.01 CHEMBL1190855

0.087 0.021 CHEMBL6200

0.065 0.036 CHEMBL3126023

0.069 0.031 CHEMBL3544720

0.073 0.029 CHEMBL3544719

0.11 0.015 CHEMBL578211

0.074 0.028 CHEMBL3544791

0.057 0.046 CHEMBL3544599

0.063 0.038 CHEMBL1614639

0.2070.0290.255 Hydroxytryptamine 2 antagonist

0.25 0.021 CHEMBL1190855

0.088 0.082 CHEMBL3126023

0.095 0.076 CHEMBL578211

0.137 0.05 CHEMBL3544721

0.119 0.059 CHEMBL3544791

CHEMBL1190855
0.1950.0190.195Alpha 2c adrenoreceptor antagonist

0.17 0.025 CHEMBL1190855

0.116 0.052 CHEMBL6200

0.129 0.044 CHEMBL3544721

0.2020.0270.437Neurotrophic factor

0.139 0.07 CHEMBL1190855

0.132 0.078 CHEMBL6200

0.116 0.102 CHEMBL3544704

0.112 0.11 CHEMBL3544720

0.14 0.068 CHEMBL578211

0.143 0.066 CHEMBL3544721

0.169 0.045 CHEMBL3544622

0.23 0.016 CHEMBL3544793

0.137 0.072 CHEMBL3544790

0.116 0.101 CHEMBL3544600

0.138 0.071 CHEMBL3544623

0.329 0.007 CHEMBL3544625

0.437 0.004 CHEMBL3544626

0.333 0.006 CHEMBL1741437

CHEMBL3544626
0.210.0370.21Tyrosine-protein kinase receptor antagonist

0.121 0.086 CHEMBL1190855

0.2 0.04 CHEMBL6200

0.121 0.086 CHEMBL3126023

0.209 0.037 CHEMBL3544719

0.182 0.048 CHEMBL578211

0.2440.0740.287Ca2+/calmodulin-dependent kinase IV inhibitor

0.194 0.183 CHEMBL1190855

0.287 0.032 CHEMBL6200

0.23 0.096 CHEMBL3544704

0.196 0.177 CHEMBL3126023

0.253 0.062 CHEMBL3544720

0.232 0.093 CHEMBL3544719

0.213 0.131 CHEMBL578211

0.22 0.116 CHEMBL3559662

0.225 0.104 CHEMBL3544599

CHEMBL6200
0.2280.0590.263MAP kinase kinase 3 inhibitor

0.204 0.111 CHEMBL3544718

0.247 0.034 CHEMBL6200

0.22 0.074 CHEMBL3126023

0.251 0.031 CHEMBL3544720

0.242 0.04 CHEMBL3544719

0.223 0.068 CHEMBL578211

0.23 0.056 CHEMBL3544721

0.263 0.021 CHEMBL3544622

0.246 0.036 CHEMBL3544599

0.2 0.123 CHEMBL3544621

0.206 0.106 CHEMBL1614639

0.208 0.1 CHEMBL3544790

0.228 0.059 CHEMBL3544600

0.205 0.109 CHEMBL3544623

0.221 0.073 CHEMBL3544624

0.243 0.039 CHEMBL3544625

0.211 0.094 CHEMBL3544626

0.237 0.046 CHEMBL1741437

CHEMBL3544622
0.1660.0040.1665 Hydroxytryptamine 3 agonist

0.077 0.029 CHEMBL3544718

0.114 0.01 CHEMBL1190855

0.132 0.006 CHEMBL6200

0.116 0.01 CHEMBL3126023

0.087 0.022 CHEMBL3544720

0.103 0.014 CHEMBL3544719

0.105 0.013 CHEMBL578211

0.068 0.037 CHEMBL3544791

0.1920.0320.192TRKA antagonist

0.106 0.082 CHEMBL1190855

0.189 0.033 CHEMBL6200

0.121 0.066 CHEMBL3126023

0.159 0.045 CHEMBL3544719

0.165 0.042 CHEMBL578211

0.1760.0180.212Histamine H1 receptor antagonist

0.153 0.023 CHEMBL3544718

0.157 0.022 CHEMBL1190855

0.074 0.064 CHEMBL3544720

0.073 0.065 CHEMBL578211

0.212 0.013 CHEMBL3544721

0.071 0.068 CHEMBL3544622

0.114 0.035 CHEMBL3544793

0.134 0.028 CHEMBL3544790

0.11 0.036 CHEMBL3544600

0.09 0.048 CHEMBL3544623

0.12 0.032 CHEMBL3544626

0.106 0.038 CHEMBL1741437

CHEMBL3544721
0.1760.0190.183Opioid antagonist

0.183 0.017 CHEMBL1190855

0.079 0.071 CHEMBL3544704

CHEMBL1190855
0.1540.0020.16Prolactin release inhibitor

0.065 0.033 CHEMBL3544718

0.16 0.002 CHEMBL1190855

0.088 0.007 CHEMBL6200

0.097 0.005 CHEMBL3544704

0.103 0.004 CHEMBL3126023

0.074 0.017 CHEMBL3544720

0.097 0.005 CHEMBL578211

0.1 0.004 CHEMBL3544791

0.064 0.037 CHEMBL3559662

0.087 0.007 CHEMBL3544793

0.077 0.014 CHEMBL3544621

0.09 0.006 CHEMBL1614639

0.064 0.037 CHEMBL3544598

CHEMBL1190855
0.2050.0540.2265 Hydroxytryptamine 3E antagonist

0.164 0.156 CHEMBL3544718

0.212 0.045 CHEMBL1190855

0.214 0.042 CHEMBL6200

0.176 0.118 CHEMBL3126023

0.168 0.142 CHEMBL3544720

0.175 0.118 CHEMBL3544719

0.226 0.03 CHEMBL3544721

0.175 0.12 CHEMBL3544622

0.163 0.162 CHEMBL3544791

0.187 0.089 CHEMBL3544600

0.169 0.138 CHEMBL1741437

CHEMBL3544721
0.1690.0220.181Protein kinase C gamma inhibitor

0.135 0.041 CHEMBL1190855

0.149 0.032 CHEMBL6200

0.137 0.04 CHEMBL3126023

0.139 0.038 CHEMBL3544720

0.151 0.031 CHEMBL3544719

0.173 0.021 CHEMBL578211

0.103 0.072 CHEMBL3544721

0.138 0.039 CHEMBL3544791

0.142 0.036 CHEMBL3544599

0.181 0.019 CHEMBL3544621

0.157 0.028 CHEMBL1614639

0.1 0.077 CHEMBL3544600

0.104 0.071 CHEMBL3544623

0.169 0.022 CHEMBL3544624

0.097 0.082 CHEMBL3544625

0.125 0.049 CHEMBL3544626

0.1 0.077 CHEMBL1741437

CHEMBL3544621
0.1610.0140.258Dopamine D1 antagonist

0.081 0.033 CHEMBL3544718

0.258 0.007 CHEMBL1190855

0.074 0.036 CHEMBL6200

0.059 0.051 CHEMBL578211

0.088 0.029 CHEMBL3544791

0.057 0.053 CHEMBL3544621

CHEMBL1190855
0.1660.0190.166Alpha 2a adrenoreceptor antagonist

0.133 0.026 CHEMBL1190855

0.102 0.036 CHEMBL6200

0.068 0.061 CHEMBL3544721

0.2480.1040.296Ca(v)3.3 blocker

0.2 0.192 CHEMBL6200

0.296 0.046 CHEMBL3544721

0.255 0.094 CHEMBL3544622

0.264 0.08 CHEMBL3544600

CHEMBL3544721
0.150.0090.15TRPA1 antagonist

0.079 0.026 CHEMBL1190855

0.077 0.027 CHEMBL3126023

0.083 0.023 CHEMBL578211

0.1460.0050.146Acetylcholine M5 receptor agonist

0.118 0.011 CHEMBL1190855

0.092 0.025 CHEMBL6200

0.09 0.026 CHEMBL3126023

0.104 0.018 CHEMBL3544719

0.143 0.005 CHEMBL578211

0.115 0.013 CHEMBL3544791

0.083 0.032 CHEMBL3544793

0.064 0.05 CHEMBL3544599

0.062 0.053 CHEMBL3544621

0.073 0.04 CHEMBL1614639

0.063 0.051 CHEMBL3544624

0.1640.0230.187Dopamine antagonist

0.187 0.02 CHEMBL1190855

0.066 0.057 CHEMBL6200

0.062 0.061 CHEMBL578211

0.071 0.053 CHEMBL3544791

CHEMBL1190855
0.1640.0240.164Alpha 2 adrenoreceptor antagonist

0.14 0.03 CHEMBL1190855

0.105 0.045 CHEMBL6200

0.076 0.072 CHEMBL3544721

0.1610.0240.224Antineoplastic alkaloid

0.187 0.017 CHEMBL1190855

0.101 0.047 CHEMBL3544704

0.173 0.021 CHEMBL578211

0.194 0.015 CHEMBL3544791

0.092 0.053 CHEMBL3559662

0.117 0.039 CHEMBL3544793

0.185 0.018 CHEMBL1614639

0.075 0.073 CHEMBL3544598

0.224 0.008 CHEMBL3544624

CHEMBL3544624
0.1460.0110.187Sigma receptor antagonist

0.187 0.009 CHEMBL1190855

0.045 0.037 CHEMBL6200

CHEMBL1190855
0.1390.0050.139Phosphodiesterase 1A inhibitor

0.084 0.014 CHEMBL1190855

0.064 0.033 CHEMBL6200

0.086 0.014 CHEMBL3126023

0.069 0.025 CHEMBL3544719

0.108 0.009 CHEMBL578211

0.07 0.025 CHEMBL3544791

0.071 0.023 CHEMBL3544793

0.058 0.045 CHEMBL1741437

0.1690.0360.178Nav1.6 sodium channel blocker

0.118 0.099 CHEMBL1190855

0.154 0.049 CHEMBL6200

0.135 0.074 CHEMBL3544719

0.178 0.029 CHEMBL3544721

0.141 0.065 CHEMBL3544622

0.113 0.107 CHEMBL3544600

CHEMBL3544721
0.1420.010.1935 Hydroxytryptamine 3 antagonist

0.064 0.032 CHEMBL3544718

0.193 0.006 CHEMBL1190855

0.055 0.041 CHEMBL6200

0.055 0.042 CHEMBL578211

0.072 0.028 CHEMBL3544791

CHEMBL1190855
0.1490.0170.149Phosphodiesterase I inhibitor

0.111 0.033 CHEMBL1190855

0.088 0.062 CHEMBL6200

0.097 0.049 CHEMBL3544704

0.097 0.048 CHEMBL3126023

0.093 0.054 CHEMBL3544719

0.115 0.03 CHEMBL578211

0.092 0.056 CHEMBL3544791

0.083 0.071 CHEMBL3559662

0.079 0.078 CHEMBL1741437

0.1350.0040.155Nicotinic receptor beta4 subunit antagonist

0.062 0.012 CHEMBL3544718

0.101 0.006 CHEMBL1190855

0.147 0.004 CHEMBL6200

0.035 0.028 CHEMBL3544704

0.094 0.007 CHEMBL3126023

0.033 0.032 CHEMBL3544720

0.155 0.004 CHEMBL3544719

0.092 0.007 CHEMBL578211

0.063 0.011 CHEMBL3544791

0.051 0.015 CHEMBL3544793

0.054 0.014 CHEMBL3544621

0.058 0.013 CHEMBL1614639

0.034 0.031 CHEMBL3544626

0.037 0.026 CHEMBL1741437

CHEMBL3544719
0.1360.0060.1365 Hydroxytryptamine 3A antagonist

0.129 0.008 CHEMBL1190855

0.09 0.022 CHEMBL6200

0.081 0.03 CHEMBL3126023

0.067 0.046 CHEMBL3544719

0.087 0.025 CHEMBL578211

0.082 0.029 CHEMBL3544791

0.067 0.046 CHEMBL3544793

0.1490.0240.1495 Hydroxytryptamine 1 antagonist

0.145 0.025 CHEMBL1190855

0.074 0.05 CHEMBL578211

0.11 0.034 CHEMBL3544721

0.072 0.052 CHEMBL3544791

0.1420.0170.18Analgesic, opioid

0.18 0.011 CHEMBL3544718

0.142 0.017 CHEMBL1190855

0.069 0.063 CHEMBL3544704

CHEMBL3544718
0.1520.0280.1745 Hydroxytryptamine 2A antagonist

0.174 0.023 CHEMBL1190855

0.09 0.052 CHEMBL3544721

0.079 0.06 CHEMBL3544791

CHEMBL1190855
0.1390.0170.149Dopamine D3 antagonist

0.149 0.015 CHEMBL1190855

0.06 0.044 CHEMBL6200

0.062 0.043 CHEMBL3126023

0.058 0.047 CHEMBL578211

0.062 0.043 CHEMBL3544791

CHEMBL1190855
0.1830.0620.202Antipruritic

0.137 0.111 CHEMBL3544718

0.162 0.081 CHEMBL1190855

0.174 0.07 CHEMBL6200

0.14 0.106 CHEMBL3544719

0.14 0.107 CHEMBL3544721

0.131 0.121 CHEMBL3544790

0.161 0.083 CHEMBL3544623

0.202 0.048 CHEMBL3544626

0.154 0.09 CHEMBL1741437

CHEMBL3544626
0.1440.0230.144Dopamine D2 antagonist

0.133 0.025 CHEMBL1190855

0.1250.0050.139Cyclin-dependent kinase 6 inhibitor

0.069 0.032 CHEMBL3544718

0.087 0.017 CHEMBL1190855

0.139 0.005 CHEMBL6200

0.091 0.014 CHEMBL3126023

0.071 0.03 CHEMBL3544720

0.089 0.015 CHEMBL3544719

0.085 0.018 CHEMBL578211

0.063 0.038 CHEMBL1614639

CHEMBL6200
0.1380.0190.138Dopamine D4 antagonist

0.1 0.026 CHEMBL1190855

0.058 0.043 CHEMBL6200

0.055 0.046 CHEMBL578211

0.1240.0060.16Glutamate (mGluR group I) agonist

0.057 0.025 CHEMBL1190855

0.091 0.01 CHEMBL6200

0.074 0.014 CHEMBL3126023

0.071 0.016 CHEMBL3544719

0.16 0.004 CHEMBL578211

0.072 0.015 CHEMBL3544791

0.045 0.037 CHEMBL3544793

0.05 0.031 CHEMBL1614639

0.045 0.036 CHEMBL3544625

0.057 0.024 CHEMBL3544626

0.081 0.012 CHEMBL1741437

CHEMBL578211
0.1410.0220.154Protein kinase C zeta inhibitor

0.097 0.054 CHEMBL1190855

0.154 0.019 CHEMBL6200

0.108 0.041 CHEMBL3126023

0.121 0.032 CHEMBL3544720

0.105 0.045 CHEMBL3544719

0.114 0.037 CHEMBL578211

0.1 0.051 CHEMBL3544599

0.111 0.039 CHEMBL1614639

0.086 0.073 CHEMBL3544624

CHEMBL6200
0.1390.0210.143Polo-like kinase-1 inhibitor

0.125 0.028 CHEMBL3544718

0.093 0.056 CHEMBL1190855

0.093 0.056 CHEMBL6200

0.098 0.048 CHEMBL3126023

0.104 0.041 CHEMBL3544719

0.143 0.019 CHEMBL578211

0.083 0.077 CHEMBL3544622

0.096 0.051 CHEMBL3544791

0.111 0.036 CHEMBL3544793

0.097 0.05 CHEMBL1741437

CHEMBL578211
0.1230.0050.146Glutamate (mGluR5) agonist

0.046 0.031 CHEMBL3544718

0.058 0.019 CHEMBL1190855

0.09 0.009 CHEMBL6200

0.078 0.011 CHEMBL3126023

0.069 0.014 CHEMBL3544719

0.146 0.004 CHEMBL578211

0.074 0.012 CHEMBL3544791

0.049 0.027 CHEMBL3544793

0.052 0.023 CHEMBL1614639

0.047 0.029 CHEMBL3544626

0.058 0.019 CHEMBL1741437

CHEMBL578211
0.190.0730.231TRKC antagonist

0.127 0.124 CHEMBL1190855

0.163 0.091 CHEMBL6200

0.231 0.055 CHEMBL3544719

0.147 0.104 CHEMBL578211

CHEMBL3544719
0.150.0340.235Interleukin 8 antagonist

0.147 0.036 CHEMBL6200

0.102 0.093 CHEMBL3126023

0.137 0.043 CHEMBL3544721

0.104 0.088 CHEMBL3544622

0.14 0.041 CHEMBL3544790

0.103 0.091 CHEMBL3544623

0.103 0.09 CHEMBL3544625

0.183 0.018 CHEMBL3544626

0.235 0.007 CHEMBL1741437

CHEMBL1741437
0.1340.0190.172Alpha adrenoreceptor agonist

0.079 0.038 CHEMBL1190855

0.172 0.012 CHEMBL6200

0.084 0.035 CHEMBL3544721

CHEMBL6200
0.1920.0780.195I kappa B kinase epsilon inhibitor

0.191 0.079 CHEMBL6200

0.16 0.109 CHEMBL3126023

0.137 0.135 CHEMBL3544719

0.155 0.114 CHEMBL578211

0.195 0.075 CHEMBL3544721

CHEMBL3544721
0.1610.0480.21Toll-Like receptor antagonist

0.21 0.027 CHEMBL1190855

0.19 0.034 CHEMBL6200

0.112 0.099 CHEMBL3544721

0.117 0.088 CHEMBL3544626

CHEMBL1190855
0.2450.1310.61Transcription factor NF kappa B inhibitor

0.268 0.115 CHEMBL1190855

0.481 0.047 CHEMBL3544704

0.193 0.176 CHEMBL3544719

0.283 0.105 CHEMBL578211

0.248 0.128 CHEMBL3544721

0.25 0.128 CHEMBL3544622

0.304 0.092 CHEMBL3544791

0.354 0.076 CHEMBL3559662

0.28 0.107 CHEMBL1614639

0.333 0.082 CHEMBL3544790

0.26 0.121 CHEMBL3544600

0.61 0.03 CHEMBL3544598

0.342 0.079 CHEMBL3544623

0.373 0.07 CHEMBL3544624

0.36 0.074 CHEMBL3544625

0.354 0.075 CHEMBL3544626

0.369 0.071 CHEMBL1741437

CHEMBL3544598
0.1650.0540.242Toll-Like receptor 9 antagonist

0.242 0.022 CHEMBL1190855

0.15 0.063 CHEMBL6200

0.116 0.09 CHEMBL3544721

0.112 0.094 CHEMBL3544791

CHEMBL1190855
0.1950.0850.211MAP kinase kinase 2 inhibitor

0.211 0.075 CHEMBL6200

0.159 0.113 CHEMBL3126023

0.143 0.128 CHEMBL3544719

0.174 0.101 CHEMBL578211

0.159 0.114 CHEMBL1614639

CHEMBL6200
0.1180.010.135Alpha 2 adrenoreceptor agonist

0.078 0.025 CHEMBL1190855

0.135 0.008 CHEMBL6200

0.054 0.052 CHEMBL3126023

0.063 0.039 CHEMBL3544721

CHEMBL6200
0.1190.010.1325 Hydroxytryptamine 6 antagonist

0.132 0.008 CHEMBL1190855

0.105 0.013 CHEMBL6200

0.078 0.024 CHEMBL3126023

CHEMBL1190855
0.1310.0230.1315 Hydroxytryptamine 1A antagonist

0.108 0.029 CHEMBL1190855

0.064 0.05 CHEMBL6200

0.069 0.047 CHEMBL578211

0.088 0.036 CHEMBL3544721

0.130.0220.139Opioid mu receptor antagonist

0.139 0.02 CHEMBL1190855

CHEMBL1190855
0.1250.0180.125Phosphodiesterase XI inhibitor

0.092 0.04 CHEMBL1190855

0.112 0.024 CHEMBL6200

0.106 0.028 CHEMBL3126023

0.112 0.024 CHEMBL3544719

0.109 0.025 CHEMBL578211

0.08 0.058 CHEMBL3544791

0.1250.0180.125Phosphodiesterase 11A inhibitor

0.092 0.04 CHEMBL1190855

0.112 0.024 CHEMBL6200

0.106 0.028 CHEMBL3126023

0.112 0.024 CHEMBL3544719

0.109 0.025 CHEMBL578211

0.08 0.058 CHEMBL3544791

0.110.0050.117Potassium channel small-conductance Ca-activated blocker

0.117 0.005 CHEMBL1190855

0.075 0.011 CHEMBL6200

0.05 0.025 CHEMBL3126023

0.048 0.026 CHEMBL578211

0.051 0.024 CHEMBL3544791

CHEMBL1190855
0.1180.0140.118Acetylcholine M3 receptor antagonist

0.094 0.02 CHEMBL1190855

0.059 0.043 CHEMBL578211

0.077 0.028 CHEMBL3544793

0.1090.0070.13Glutamate (mGluR7) antagonist

0.068 0.046 CHEMBL3544718

0.077 0.032 CHEMBL1190855

0.074 0.035 CHEMBL6200

0.119 0.005 CHEMBL3126023

0.089 0.018 CHEMBL3544720

0.094 0.014 CHEMBL3544719

0.13 0.004 CHEMBL578211

0.078 0.03 CHEMBL3544622

0.097 0.012 CHEMBL3544791

0.085 0.022 CHEMBL3544793

0.11 0.006 CHEMBL3544599

0.08 0.028 CHEMBL3544621

0.111 0.006 CHEMBL1614639

0.097 0.012 CHEMBL3544790

0.091 0.017 CHEMBL3544623

0.104 0.009 CHEMBL3544624

0.087 0.02 CHEMBL3544625

0.127 0.004 CHEMBL3544626

0.121 0.005 CHEMBL1741437

CHEMBL578211
0.1110.0090.111Protein kinase C beta inhibitor

0.101 0.013 CHEMBL1190855

0.103 0.012 CHEMBL6200

0.108 0.01 CHEMBL3544704

0.077 0.034 CHEMBL3126023

0.083 0.026 CHEMBL3544720

0.088 0.021 CHEMBL3544719

0.087 0.022 CHEMBL578211

0.079 0.031 CHEMBL3544791

0.064 0.06 CHEMBL3559662

0.07 0.048 CHEMBL3544599

0.092 0.018 CHEMBL3544621

0.081 0.029 CHEMBL1614639

0.085 0.024 CHEMBL3544624

0.064 0.061 CHEMBL3544626

0.1470.0490.147TRKB antagonist

0.112 0.084 CHEMBL1190855

0.114 0.081 CHEMBL6200

0.123 0.07 CHEMBL3544719

0.114 0.081 CHEMBL578211

0.1130.0190.1135 Hydroxytryptamine 1B antagonist

0.113 0.019 CHEMBL1190855

0.058 0.054 CHEMBL578211

0.068 0.042 CHEMBL3544721

0.058 0.054 CHEMBL3544791

0.1070.0140.1075 Hydroxytryptamine 5 antagonist

0.07 0.026 CHEMBL1190855

0.089 0.018 CHEMBL3544721

0.0950.0050.1195 Hydroxytryptamine 3B antagonist

0.119 0.004 CHEMBL1190855

0.035 0.026 CHEMBL6200

0.039 0.022 CHEMBL3126023

0.042 0.019 CHEMBL578211

0.056 0.012 CHEMBL3544791

CHEMBL1190855
0.1590.0690.27Cytidine deaminase inhibitor

0.219 0.039 CHEMBL1190855

0.27 0.024 CHEMBL3544704

0.136 0.086 CHEMBL578211

0.195 0.05 CHEMBL3544791

0.194 0.051 CHEMBL3559662

0.128 0.093 CHEMBL1614639

0.16 0.068 CHEMBL1741437

CHEMBL3544704
0.1990.110.607Tumour necrosis factor alpha release inhibitor

0.418 0.024 CHEMBL3544718

0.297 0.054 CHEMBL3544719

0.219 0.093 CHEMBL578211

0.607 0.007 CHEMBL3544793

0.206 0.104 CHEMBL3544621

0.335 0.042 CHEMBL1614639

0.285 0.059 CHEMBL3544600

0.308 0.05 CHEMBL3544598

0.269 0.066 CHEMBL3544623

0.493 0.014 CHEMBL3544624

0.286 0.059 CHEMBL3544625

0.232 0.084 CHEMBL3544626

0.201 0.108 CHEMBL1741437

CHEMBL3544793
0.1040.0150.1045 Hydroxytryptamine 5A antagonist

0.079 0.024 CHEMBL1190855

0.088 0.02 CHEMBL3544721

0.1440.0550.249Glutamate receptor antagonist

0.106 0.089 CHEMBL1190855

0.249 0.016 CHEMBL6200

0.211 0.023 CHEMBL3544719

0.121 0.073 CHEMBL3544721

0.138 0.06 CHEMBL3544622

0.104 0.091 CHEMBL3544793

0.17 0.038 CHEMBL3544790

0.113 0.082 CHEMBL3544626

0.172 0.037 CHEMBL1741437

CHEMBL6200
0.0910.0030.0915 Hydroxytryptamine 6 agonist

0.029 0.018 CHEMBL3544718

0.09 0.003 CHEMBL1190855

0.052 0.004 CHEMBL6200

0.043 0.006 CHEMBL3126023

0.03 0.018 CHEMBL3544720

0.032 0.014 CHEMBL578211

0.032 0.014 CHEMBL3544791

0.0970.0090.126Histamine agonist

0.06 0.027 CHEMBL1190855

0.087 0.012 CHEMBL6200

0.047 0.045 CHEMBL3544719

0.126 0.006 CHEMBL3544721

0.047 0.045 CHEMBL3544622

0.07 0.019 CHEMBL3544600

CHEMBL3544721
0.10.0130.11Orexin receptor 1 antagonist

0.079 0.036 CHEMBL1190855

0.072 0.048 CHEMBL6200

0.075 0.043 CHEMBL3126023

0.076 0.042 CHEMBL3544719

0.11 0.009 CHEMBL578211

0.087 0.025 CHEMBL3544791

0.074 0.046 CHEMBL3544621

0.083 0.031 CHEMBL1614639

CHEMBL578211
0.1910.1040.36Nitric-oxide synthase stimulant

0.183 0.121 CHEMBL3544718

0.252 0.031 CHEMBL6200

0.198 0.092 CHEMBL3126023

0.173 0.144 CHEMBL3544720

0.272 0.02 CHEMBL3544719

0.209 0.074 CHEMBL578211

0.29 0.014 CHEMBL3544721

0.292 0.013 CHEMBL3544622

0.249 0.033 CHEMBL3544793

0.191 0.105 CHEMBL3544599

0.192 0.102 CHEMBL3544621

0.233 0.046 CHEMBL1614639

0.301 0.011 CHEMBL3544790

0.271 0.021 CHEMBL3544600

0.232 0.047 CHEMBL3544598

0.329 0.006 CHEMBL3544623

0.265 0.023 CHEMBL3544624

0.262 0.025 CHEMBL3544625

0.303 0.01 CHEMBL3544626

0.36 0.004 CHEMBL1741437

CHEMBL1741437
0.1060.020.1155 Hydroxytryptamine 1D antagonist

0.115 0.018 CHEMBL1190855

CHEMBL1190855
0.1150.0290.239Glutamate receptor agonist

0.091 0.044 CHEMBL6200

0.089 0.045 CHEMBL3544719

0.239 0.007 CHEMBL578211

0.07 0.062 CHEMBL3544721

0.104 0.034 CHEMBL3544622

0.146 0.018 CHEMBL3544791

0.199 0.01 CHEMBL3544790

0.128 0.024 CHEMBL3544625

0.18 0.013 CHEMBL3544626

0.198 0.011 CHEMBL1741437

CHEMBL578211
0.0960.0110.096Potassium channel (Tandem pore domain) blocker

0.086 0.022 CHEMBL1190855

0.083 0.028 CHEMBL6200

0.076 0.046 CHEMBL3126023

0.072 0.056 CHEMBL578211

0.071 0.06 CHEMBL3544600

0.1070.0260.107mTOR complex 2 inhibitor

0.087 0.052 CHEMBL1190855

0.106 0.027 CHEMBL6200

0.085 0.057 CHEMBL3126023

0.088 0.052 CHEMBL3544719

0.08 0.068 CHEMBL578211

0.093 0.043 CHEMBL3544624

0.1050.0240.109Cyclin-dependent kinase 4 inhibitor

0.076 0.037 CHEMBL1190855

0.109 0.022 CHEMBL6200

0.063 0.048 CHEMBL3126023

0.069 0.042 CHEMBL3544719

0.064 0.046 CHEMBL578211

CHEMBL6200
0.0940.0150.104Orexin receptor antagonist

0.075 0.033 CHEMBL1190855

0.064 0.051 CHEMBL3126023

0.061 0.057 CHEMBL3544719

0.104 0.01 CHEMBL578211

0.083 0.024 CHEMBL3544791

0.07 0.041 CHEMBL1614639

CHEMBL578211
0.1150.0360.115mTOR complex 1 inhibitor

0.096 0.071 CHEMBL3126023

0.093 0.078 CHEMBL578211

0.103 0.056 CHEMBL3544624

0.1440.0650.162Pregnane X receptor agonist

0.13 0.101 CHEMBL1190855

0.126 0.11 CHEMBL6200

0.131 0.098 CHEMBL3126023

0.123 0.121 CHEMBL578211

0.124 0.118 CHEMBL3544790

0.162 0.035 CHEMBL3544623

0.123 0.119 CHEMBL3544624

0.13 0.101 CHEMBL3544625

0.141 0.07 CHEMBL3544626

0.131 0.097 CHEMBL1741437

CHEMBL3544623
0.0840.0050.104Acetylcholine M4 receptor agonist

0.062 0.009 CHEMBL1190855

0.043 0.014 CHEMBL6200

0.034 0.019 CHEMBL3126023

0.082 0.005 CHEMBL3544719

0.104 0.004 CHEMBL578211

0.086 0.005 CHEMBL3544791

0.039 0.015 CHEMBL3544793

0.038 0.016 CHEMBL1614639

0.034 0.018 CHEMBL3544624

CHEMBL578211
0.1010.0240.101Polo-like kinase-2 inhibitor

0.074 0.049 CHEMBL1190855

0.066 0.057 CHEMBL6200

0.091 0.034 CHEMBL3126023

0.099 0.026 CHEMBL578211

0.071 0.052 CHEMBL3544791

0.1060.0290.112Opioid delta receptor antagonist

0.112 0.028 CHEMBL1190855

CHEMBL1190855
0.1080.0320.13Bromodomain-containing protein 2 inhibitor

0.115 0.027 CHEMBL1190855

0.091 0.053 CHEMBL6200

0.103 0.036 CHEMBL3126023

0.107 0.033 CHEMBL3544719

0.123 0.021 CHEMBL578211

0.13 0.017 CHEMBL3544791

CHEMBL3544791
0.1010.0260.101Glutamate (mGluR group I) antagonist

0.07 0.048 CHEMBL3126023

0.064 0.057 CHEMBL3544719

0.091 0.03 CHEMBL578211

0.066 0.054 CHEMBL3544793

0.1420.0670.171Ca2+-transporting ATPase inhibitor

0.146 0.053 CHEMBL1190855

0.135 0.097 CHEMBL6200

0.129 0.125 CHEMBL3544704

0.146 0.053 CHEMBL3126023

0.14 0.073 CHEMBL3544720

0.134 0.099 CHEMBL3544719

0.141 0.069 CHEMBL578211

0.134 0.101 CHEMBL3544622

0.145 0.055 CHEMBL3544791

0.133 0.105 CHEMBL3544793

0.139 0.076 CHEMBL3544599

0.155 0.033 CHEMBL1614639

0.169 0.014 CHEMBL3544790

0.152 0.039 CHEMBL3544598

0.171 0.012 CHEMBL3544623

0.168 0.015 CHEMBL3544624

0.159 0.025 CHEMBL3544625

0.165 0.018 CHEMBL3544626

0.163 0.02 CHEMBL1741437

CHEMBL3544623
0.110.0360.142Phosphodiesterase 6D inhibitor

0.101 0.05 CHEMBL6200

0.098 0.056 CHEMBL3126023

0.097 0.059 CHEMBL3544720

0.122 0.023 CHEMBL3544719

0.124 0.022 CHEMBL578211

0.087 0.085 CHEMBL3544622

0.09 0.075 CHEMBL3544791

0.096 0.061 CHEMBL3559662

0.109 0.037 CHEMBL3544599

0.101 0.05 CHEMBL1614639

0.091 0.074 CHEMBL3544790

0.09 0.076 CHEMBL3544600

0.127 0.02 CHEMBL3544598

0.099 0.054 CHEMBL3544623

0.103 0.046 CHEMBL3544625

0.142 0.012 CHEMBL3544626

0.119 0.026 CHEMBL1741437

CHEMBL3544626
0.0940.020.094Dopamine uptake inhibitor

0.094 0.02 CHEMBL1190855

0.071 0.029 CHEMBL6200

0.06 0.038 CHEMBL3544720

0.0970.0230.136Toll-Like receptor 7 antagonist

0.089 0.029 CHEMBL1190855

0.136 0.008 CHEMBL6200

CHEMBL6200
0.0920.0190.092Alpha 1 adrenoreceptor agonist

0.061 0.035 CHEMBL1190855

0.058 0.038 CHEMBL6200

0.058 0.039 CHEMBL3544721

0.1670.0940.19MAP kinase kinase 5 inhibitor

0.152 0.143 CHEMBL1190855

0.19 0.046 CHEMBL6200

0.152 0.146 CHEMBL3544720

0.164 0.101 CHEMBL3544719

CHEMBL6200
0.150.0770.306Diuretic

0.181 0.053 CHEMBL3544720

0.132 0.093 CHEMBL578211

0.123 0.101 CHEMBL3544721

0.139 0.086 CHEMBL3544622

0.306 0.021 CHEMBL3544599

0.238 0.033 CHEMBL3544621

0.221 0.037 CHEMBL3544790

0.116 0.109 CHEMBL3544600

0.223 0.037 CHEMBL3544598

0.127 0.097 CHEMBL3544624

0.19 0.048 CHEMBL3544626

0.177 0.055 CHEMBL1741437

CHEMBL3544599
0.1980.1260.483DNA synthesis inhibitor

0.172 0.165 CHEMBL3544718

0.209 0.11 CHEMBL1190855

0.276 0.053 CHEMBL6200

0.483 0.015 CHEMBL3544704

0.186 0.145 CHEMBL3126023

0.277 0.052 CHEMBL3544719

0.229 0.084 CHEMBL578211

0.2 0.123 CHEMBL3544721

0.238 0.076 CHEMBL3544622

0.24 0.074 CHEMBL3544791

0.451 0.017 CHEMBL3559662

0.225 0.088 CHEMBL3544793

0.206 0.114 CHEMBL3544621

0.248 0.067 CHEMBL1614639

0.322 0.037 CHEMBL3544790

0.172 0.165 CHEMBL3544600

0.39 0.023 CHEMBL3544598

0.271 0.055 CHEMBL3544623

0.229 0.084 CHEMBL3544624

0.23 0.083 CHEMBL3544625

0.288 0.048 CHEMBL3544626

0.253 0.065 CHEMBL1741437

CHEMBL3544704
0.0860.0150.086Phosphodiesterase 1C inhibitor

0.06 0.048 CHEMBL1190855

0.063 0.041 CHEMBL3126023

0.072 0.027 CHEMBL578211

0.0890.0190.089CDK4/cyclin D1 inhibitor

0.071 0.03 CHEMBL1190855

0.086 0.02 CHEMBL6200

0.054 0.044 CHEMBL3126023

0.062 0.037 CHEMBL3544719

0.061 0.038 CHEMBL578211

0.0740.0050.074Nerve growth factor antagonist

0.047 0.023 CHEMBL3544718

0.066 0.007 CHEMBL1190855

0.054 0.014 CHEMBL6200

0.059 0.01 CHEMBL3126023

0.051 0.017 CHEMBL3544720

0.054 0.014 CHEMBL3544719

0.063 0.008 CHEMBL578211

0.041 0.034 CHEMBL3544721

0.055 0.013 CHEMBL3544791

0.041 0.033 CHEMBL3544793

0.042 0.031 CHEMBL3544599

0.042 0.032 CHEMBL3544621

0.054 0.014 CHEMBL3544790

0.046 0.024 CHEMBL3544623

0.045 0.025 CHEMBL3544625

0.057 0.012 CHEMBL3544626

0.06 0.009 CHEMBL1741437

0.2210.1530.642Antithrombotic

0.195 0.184 CHEMBL6200

0.441 0.04 CHEMBL3544704

0.191 0.188 CHEMBL3544719

0.244 0.131 CHEMBL3544721

0.236 0.137 CHEMBL3544622

0.263 0.116 CHEMBL1614639

0.419 0.045 CHEMBL3544790

0.237 0.137 CHEMBL3544600

0.642 0.012 CHEMBL3544598

0.45 0.038 CHEMBL3544623

0.441 0.04 CHEMBL3544624

0.474 0.033 CHEMBL3544625

0.593 0.017 CHEMBL3544626

0.534 0.025 CHEMBL1741437

CHEMBL3544598
0.1830.1150.359Aldehyde oxidase inhibitor

0.189 0.111 CHEMBL1190855

0.234 0.088 CHEMBL3544790

0.19 0.11 CHEMBL3544623

0.209 0.1 CHEMBL3544624

0.179 0.117 CHEMBL3544625

0.244 0.084 CHEMBL3544626

0.359 0.054 CHEMBL1741437

CHEMBL1741437
0.120.0520.208Activin receptor-like kinase 4 inhibitor

0.208 0.012 CHEMBL6200

0.112 0.063 CHEMBL3126023

0.101 0.084 CHEMBL3544720

0.129 0.042 CHEMBL3544719

0.103 0.079 CHEMBL578211

0.119 0.054 CHEMBL1741437

CHEMBL6200
0.210.1420.409Insulysin inhibitor

0.193 0.168 CHEMBL1190855

0.273 0.077 CHEMBL6200

0.195 0.165 CHEMBL3544720

0.263 0.085 CHEMBL3544719

0.192 0.17 CHEMBL578211

0.297 0.06 CHEMBL3544721

0.328 0.043 CHEMBL3544622

0.225 0.123 CHEMBL3544793

0.335 0.04 CHEMBL3544790

0.311 0.052 CHEMBL3544600

0.288 0.066 CHEMBL3544623

0.334 0.04 CHEMBL3544625

0.409 0.02 CHEMBL3544626

0.365 0.029 CHEMBL1741437

CHEMBL3544626
0.0830.0160.168Dopamine transporter inhibitor

0.082 0.016 CHEMBL1190855

0.078 0.018 CHEMBL6200

0.168 0.005 CHEMBL3544720

0.125 0.008 CHEMBL3544599

0.055 0.028 CHEMBL1614639

CHEMBL3544720
0.0980.0310.129Caspase 7 inhibitor

0.122 0.014 CHEMBL1190855

0.091 0.039 CHEMBL6200

0.078 0.065 CHEMBL3126023

0.076 0.07 CHEMBL3544719

0.102 0.026 CHEMBL578211

0.129 0.012 CHEMBL3544791

0.096 0.034 CHEMBL3544790

0.081 0.058 CHEMBL3544600

0.115 0.017 CHEMBL3544626

0.087 0.046 CHEMBL1741437

CHEMBL3544791
0.0810.0140.081Glutamate (mGluR5) antagonist

0.059 0.023 CHEMBL3126023

0.064 0.02 CHEMBL578211

0.0860.0190.086Phosphodiesterase 1B inhibitor

0.054 0.052 CHEMBL3126023

0.063 0.038 CHEMBL578211

0.0710.0060.0715 Hydroxytryptamine 1D agonist

0.057 0.008 CHEMBL1190855

0.028 0.02 CHEMBL6200

0.03 0.019 CHEMBL3544721

0.0950.0290.106Transforming growth factor beta 3 antagonist

0.106 0.018 CHEMBL3544718

0.094 0.031 CHEMBL6200

0.083 0.054 CHEMBL3126023

0.078 0.071 CHEMBL578211

CHEMBL3544718
0.1340.070.22Death-associated protein kinase 1 inhibitor

0.185 0.011 CHEMBL6200

0.126 0.092 CHEMBL3126023

0.133 0.074 CHEMBL3544720

0.146 0.046 CHEMBL3544719

0.132 0.075 CHEMBL578211

0.16 0.027 CHEMBL3544721

0.22 0.005 CHEMBL3544622

0.131 0.079 CHEMBL3544599

0.168 0.02 CHEMBL3544790

0.188 0.01 CHEMBL3544600

0.128 0.087 CHEMBL3544624

0.131 0.077 CHEMBL1741437

CHEMBL3544622
0.1490.0850.275Polo-like kinase-3 inhibitor

0.275 0.017 CHEMBL3544718

0.135 0.103 CHEMBL6200

0.163 0.071 CHEMBL578211

CHEMBL3544718
0.0770.0130.152Opioid kappa receptor agonist

0.043 0.03 CHEMBL3544718

0.072 0.014 CHEMBL1190855

0.152 0.005 CHEMBL3544624

CHEMBL3544624
0.140.0760.18Heat shock protein 70 antagonist

0.139 0.079 CHEMBL1190855

0.18 0.012 CHEMBL3544704

0.135 0.095 CHEMBL3126023

0.136 0.091 CHEMBL578211

0.135 0.094 CHEMBL3544791

0.141 0.07 CHEMBL3559662

0.144 0.063 CHEMBL1614639

0.146 0.056 CHEMBL3544790

0.13 0.122 CHEMBL3544600

0.141 0.072 CHEMBL3544598

0.138 0.083 CHEMBL3544623

0.166 0.021 CHEMBL3544625

0.158 0.03 CHEMBL3544626

0.151 0.043 CHEMBL1741437

CHEMBL3544704
0.1910.1290.334Interleukin agonist

0.203 0.118 CHEMBL1190855

0.231 0.093 CHEMBL6200

0.307 0.045 CHEMBL3544704

0.305 0.045 CHEMBL3544719

0.275 0.062 CHEMBL578211

0.225 0.099 CHEMBL3544622

0.285 0.056 CHEMBL3544791

0.307 0.045 CHEMBL3559662

0.241 0.086 CHEMBL3544793

0.201 0.12 CHEMBL3544621

0.227 0.097 CHEMBL3544790

0.311 0.043 CHEMBL3544598

0.295 0.05 CHEMBL3544623

0.245 0.083 CHEMBL3544625

0.334 0.034 CHEMBL3544626

0.317 0.04 CHEMBL1741437

CHEMBL3544626
0.0760.0140.1215 Hydroxytryptamine 4 antagonist

0.121 0.004 CHEMBL1190855

0.051 0.036 CHEMBL3544721

0.052 0.034 CHEMBL3544791

CHEMBL1190855
0.1270.0670.186Nav1.3 sodium channel blocker

0.136 0.059 CHEMBL1190855

0.103 0.094 CHEMBL6200

0.186 0.029 CHEMBL3544721

CHEMBL3544721
0.1030.0430.129Pim-3 kinase inhibitor

0.129 0.026 CHEMBL6200

0.085 0.067 CHEMBL3544719

CHEMBL6200
0.1180.0580.169Polo-like kinase-4 inhibitor

0.109 0.067 CHEMBL6200

0.126 0.052 CHEMBL3544719

0.169 0.026 CHEMBL578211

0.121 0.056 CHEMBL3544791

0.118 0.058 CHEMBL3544793

0.1 0.077 CHEMBL3544599

CHEMBL578211
0.2040.1440.348Gastrin inhibitor

0.221 0.118 CHEMBL6200

0.191 0.163 CHEMBL578211

0.272 0.056 CHEMBL3544721

0.275 0.053 CHEMBL3544622

0.348 0.011 CHEMBL3544790

0.293 0.038 CHEMBL3544600

0.262 0.066 CHEMBL3544623

0.343 0.012 CHEMBL3544625

0.338 0.014 CHEMBL3544626

0.329 0.017 CHEMBL1741437

CHEMBL3544790
0.1020.0440.106Alpha 2d adrenoreceptor antagonist

0.102 0.045 CHEMBL1190855

0.106 0.039 CHEMBL6200

0.089 0.074 CHEMBL3544721

CHEMBL6200
0.0770.020.077Opioid agonist

0.07 0.023 CHEMBL1190855

0.0830.0250.095 Hydroxytryptamine 2A agonist

0.08 0.028 CHEMBL1190855

0.09 0.019 CHEMBL6200

0.086 0.022 CHEMBL3544719

0.057 0.05 CHEMBL578211

CHEMBL6200
0.0760.0190.124Toll-Like receptor 8 antagonist

0.054 0.037 CHEMBL1190855

0.124 0.005 CHEMBL6200

0.053 0.037 CHEMBL3544719

CHEMBL6200
0.1220.0650.153Anesthetic local

0.129 0.061 CHEMBL1190855

0.153 0.048 CHEMBL3544721

CHEMBL3544721
0.0740.0180.106Histamine H3 receptor antagonist

0.038 0.036 CHEMBL1190855

0.069 0.019 CHEMBL6200

0.106 0.011 CHEMBL3544721

0.045 0.029 CHEMBL3544600

CHEMBL3544721
0.0690.0130.084Histamine H4 receptor antagonist

0.056 0.023 CHEMBL1190855

0.084 0.008 CHEMBL6200

CHEMBL6200
0.0780.0230.078CDK4/cyclin D inhibitor

0.058 0.041 CHEMBL1190855

0.074 0.024 CHEMBL6200

0.054 0.047 CHEMBL3126023

0.059 0.04 CHEMBL3544719

0.059 0.04 CHEMBL578211

0.1070.0520.136Alpha adrenoreceptor antagonist

0.136 0.042 CHEMBL1190855

CHEMBL1190855
0.0730.0180.0835 Hydroxytryptamine 2 agonist

0.08 0.015 CHEMBL1190855

0.083 0.014 CHEMBL6200

0.057 0.03 CHEMBL3544719

CHEMBL6200
0.0920.040.097Glutamate (mGluR) antagonist

0.072 0.058 CHEMBL3544719

0.097 0.037 CHEMBL578211

0.096 0.037 CHEMBL3544622

0.086 0.044 CHEMBL3544790

CHEMBL578211
0.1390.0890.215GABA C receptor rho-2 antagonist

0.134 0.099 CHEMBL1190855

0.184 0.039 CHEMBL6200

0.142 0.085 CHEMBL3126023

0.135 0.097 CHEMBL3544720

0.162 0.059 CHEMBL3544719

0.143 0.084 CHEMBL578211

0.214 0.022 CHEMBL3544721

0.134 0.098 CHEMBL3544622

0.137 0.093 CHEMBL3544791

0.138 0.092 CHEMBL3544599

0.161 0.06 CHEMBL3544790

0.171 0.05 CHEMBL3544600

0.138 0.092 CHEMBL3544623

0.161 0.06 CHEMBL3544624

0.172 0.049 CHEMBL3544625

0.18 0.042 CHEMBL3544626

0.215 0.022 CHEMBL1741437

CHEMBL1741437
0.0590.0090.0815 Hydroxytryptamine 2B agonist

0.046 0.017 CHEMBL1190855

0.081 0.005 CHEMBL6200

0.038 0.028 CHEMBL3126023

0.057 0.009 CHEMBL3544719

0.041 0.023 CHEMBL578211

CHEMBL6200
0.0590.0090.082Histamine H1 receptor agonist

0.053 0.014 CHEMBL1190855

0.055 0.012 CHEMBL6200

0.049 0.02 CHEMBL3126023

0.043 0.033 CHEMBL3544719

0.042 0.035 CHEMBL578211

0.082 0.003 CHEMBL3544721

0.057 0.011 CHEMBL3544622

0.067 0.005 CHEMBL3544600

0.041 0.039 CHEMBL1741437

CHEMBL3544721
0.070.020.07Opioid mu receptor agonist

0.062 0.023 CHEMBL1190855

0.0690.020.0785 Hydroxytryptamine 7 agonist

0.075 0.016 CHEMBL1190855

0.057 0.037 CHEMBL578211

0.055 0.04 CHEMBL3544721

0.058 0.034 CHEMBL3544622

0.061 0.029 CHEMBL3544791

0.078 0.014 CHEMBL3544600

CHEMBL3544600
0.0760.0270.101Potassium channel Kv1.5 blocker

0.066 0.032 CHEMBL6200

0.088 0.022 CHEMBL3544719

0.101 0.018 CHEMBL578211

0.053 0.044 CHEMBL3544791

CHEMBL578211
0.0570.0080.057Sigma 2 receptor antagonist

0.056 0.009 CHEMBL1190855

0.0530.0040.053Dopamine D1 agonist

0.045 0.005 CHEMBL1190855

0.033 0.008 CHEMBL6200

0.028 0.01 CHEMBL3544704

0.024 0.014 CHEMBL3126023

0.022 0.018 CHEMBL578211

0.023 0.015 CHEMBL3544598

0.1120.0650.127Nav1.5 sodium channel blocker

0.11 0.068 CHEMBL1190855

0.127 0.047 CHEMBL6200

0.123 0.051 CHEMBL3544719

0.097 0.09 CHEMBL3544721

0.098 0.089 CHEMBL1741437

CHEMBL6200
0.0740.0270.0745 Hydroxytryptamine 1 agonist

0.063 0.031 CHEMBL1190855

0.1070.060.601GABA C receptor agonist

0.11 0.057 CHEMBL1190855

0.271 0.011 CHEMBL6200

0.102 0.065 CHEMBL3126023

0.118 0.051 CHEMBL3544720

0.178 0.025 CHEMBL3544719

0.091 0.077 CHEMBL578211

0.164 0.029 CHEMBL3544721

0.2 0.02 CHEMBL3544622

0.094 0.074 CHEMBL3544791

0.101 0.066 CHEMBL3544599

0.108 0.059 CHEMBL3544621

0.544 0.003 CHEMBL3544790

0.095 0.073 CHEMBL3544600

0.466 0.004 CHEMBL3544623

0.133 0.041 CHEMBL3544624

0.502 0.004 CHEMBL3544625

0.601 0.003 CHEMBL3544626

0.595 0.003 CHEMBL1741437

CHEMBL3544626
0.0690.0220.069mTOR inhibitor

0.054 0.034 CHEMBL6200

0.047 0.042 CHEMBL3126023

0.1010.0540.213HIV-1 integrase (Overall Integration) inhibitor

0.098 0.056 CHEMBL1190855

0.097 0.058 CHEMBL6200

0.128 0.035 CHEMBL3544622

0.213 0.009 CHEMBL3544790

0.15 0.025 CHEMBL3544623

0.095 0.059 CHEMBL3544624

0.162 0.021 CHEMBL3544625

0.181 0.016 CHEMBL3544626

0.181 0.016 CHEMBL1741437

CHEMBL3544790
0.180.1340.35DNA damaging

0.236 0.089 CHEMBL1190855

0.19 0.124 CHEMBL6200

0.2 0.115 CHEMBL3544704

0.185 0.129 CHEMBL3544719

0.265 0.073 CHEMBL3544721

0.195 0.119 CHEMBL3544622

0.193 0.121 CHEMBL3544791

0.173 0.142 CHEMBL3559662

0.248 0.082 CHEMBL3544790

0.177 0.138 CHEMBL3544600

0.16 0.157 CHEMBL3544623

0.35 0.041 CHEMBL3544624

0.226 0.096 CHEMBL3544625

0.314 0.052 CHEMBL3544626

0.221 0.1 CHEMBL1741437

CHEMBL3544624
0.0950.0480.175Acetylcholine M3 receptor agonist

0.092 0.05 CHEMBL1190855

0.09 0.051 CHEMBL6200

0.163 0.013 CHEMBL3544719

0.174 0.009 CHEMBL578211

0.175 0.009 CHEMBL3544791

0.074 0.066 CHEMBL3559662

0.163 0.013 CHEMBL3544793

0.104 0.043 CHEMBL1614639

0.085 0.056 CHEMBL3544624

CHEMBL3544791
0.0850.0390.0855 Hydroxytryptamine agonist

0.084 0.04 CHEMBL1190855

0.064 0.051 CHEMBL6200

0.0720.0260.072Cyclin D1 inhibitor

0.062 0.04 CHEMBL1190855

0.062 0.039 CHEMBL6200

0.062 0.039 CHEMBL3126023

0.055 0.051 CHEMBL3544720

0.061 0.04 CHEMBL3544719

0.069 0.03 CHEMBL578211

0.058 0.046 CHEMBL3544791

0.0540.0080.05411-Beta-hydroxysteroid dehydrogenase 2 inhibitor

0.035 0.013 CHEMBL1190855

0.034 0.014 CHEMBL3126023

0.034 0.014 CHEMBL578211

0.026 0.021 CHEMBL1614639

0.024 0.023 CHEMBL3544598

0.026 0.021 CHEMBL1741437

0.0580.0120.07Alpha 1d adrenoreceptor agonist

0.04 0.025 CHEMBL1190855

0.07 0.007 CHEMBL6200

0.05 0.016 CHEMBL3126023

0.049 0.017 CHEMBL3544720

0.038 0.027 CHEMBL3544719

0.038 0.028 CHEMBL3544721

CHEMBL6200
0.0560.0110.072Orexin receptor 2 antagonist

0.038 0.023 CHEMBL1190855

0.072 0.007 CHEMBL578211

0.046 0.015 CHEMBL3544791

0.036 0.025 CHEMBL1614639

CHEMBL578211
0.220.1760.478Immunosuppressant

0.296 0.117 CHEMBL6200

0.393 0.066 CHEMBL3544704

0.408 0.06 CHEMBL3544720

0.242 0.154 CHEMBL3559662

0.39 0.068 CHEMBL3544599

0.204 0.193 CHEMBL1614639

0.337 0.093 CHEMBL3544790

0.444 0.049 CHEMBL3544598

0.441 0.05 CHEMBL3544623

0.478 0.039 CHEMBL3544624

0.379 0.072 CHEMBL3544625

0.423 0.055 CHEMBL3544626

0.295 0.118 CHEMBL1741437

CHEMBL3544624
0.0470.0030.054NMDA receptor phencyclidine site antagonist

0.047 0.003 CHEMBL1190855

0.054 0.003 CHEMBL6200

0.017 0.009 CHEMBL3126023

CHEMBL6200
0.090.0470.185Histamine H2 receptor antagonist

0.1 0.035 CHEMBL1190855

0.185 0.006 CHEMBL3544721

0.118 0.022 CHEMBL3544622

0.148 0.01 CHEMBL3544600

CHEMBL3544721
0.140.0980.148Heat shock protein 90 alpha antagonist

0.142 0.096 CHEMBL3544719

0.148 0.088 CHEMBL3544622

0.136 0.104 CHEMBL3544793

0.124 0.12 CHEMBL3544600

CHEMBL3544622
0.1060.0640.135Falcipain 3 inhibitor

0.101 0.069 CHEMBL1190855

0.135 0.044 CHEMBL3544721

0.098 0.073 CHEMBL3544622

0.104 0.066 CHEMBL3544600

0.119 0.054 CHEMBL3544626

0.12 0.054 CHEMBL1741437

CHEMBL3544721
0.1480.1070.194Neurotensin receptor agonist

0.161 0.078 CHEMBL1190855

0.16 0.08 CHEMBL6200

0.159 0.081 CHEMBL3544719

0.159 0.081 CHEMBL3544721

0.169 0.064 CHEMBL3544622

0.15 0.101 CHEMBL3544791

0.173 0.058 CHEMBL3544790

0.159 0.082 CHEMBL3544600

0.142 0.123 CHEMBL3544623

0.17 0.062 CHEMBL3544625

0.194 0.038 CHEMBL3544626

0.178 0.052 CHEMBL1741437

CHEMBL3544626
0.0630.0230.0735 Hydroxytryptamine 1B agonist

0.073 0.016 CHEMBL1190855

0.058 0.028 CHEMBL3544721

0.048 0.047 CHEMBL3544791

CHEMBL1190855
0.1270.0880.127CDC-like kinase 1 inhibitor

0.115 0.1 CHEMBL578211

0.0690.030.081Corticotropin releasing factor 2 receptor antagonist

0.057 0.052 CHEMBL1190855

0.069 0.029 CHEMBL6200

0.058 0.051 CHEMBL3126023

0.081 0.017 CHEMBL3544719

0.081 0.016 CHEMBL578211

0.068 0.031 CHEMBL3544791

CHEMBL578211
0.0980.0590.156Protein kinase C mu inhibitor

0.124 0.039 CHEMBL6200

0.156 0.023 CHEMBL3544720

0.081 0.079 CHEMBL3544719

0.136 0.032 CHEMBL3544599

0.102 0.055 CHEMBL3544624

CHEMBL3544720
0.0530.0140.053Baculoviral IAP repeat-containing protein inhibitor

0.049 0.023 CHEMBL1190855

0.047 0.029 CHEMBL6200

0.047 0.028 CHEMBL3126023

0.049 0.024 CHEMBL3544719

0.051 0.019 CHEMBL578211

0.047 0.03 CHEMBL3544791

0.0660.0290.066Fatty acid synthase inhibitor

0.051 0.05 CHEMBL3544719

0.058 0.038 CHEMBL578211

0.057 0.039 CHEMBL3544622

0.051 0.05 CHEMBL3544793

0.055 0.042 CHEMBL3544790

0.080.0450.08Rho-associated kinase II inhibitor

0.067 0.06 CHEMBL6200

0.050.0160.05TRPM8 blocker

0.035 0.031 CHEMBL6200

0.034 0.033 CHEMBL578211

0.0970.0630.143Creatine kinase inhibitor

0.102 0.057 CHEMBL1190855

0.088 0.074 CHEMBL6200

0.1 0.06 CHEMBL3126023

0.084 0.08 CHEMBL3544719

0.092 0.069 CHEMBL578211

0.094 0.067 CHEMBL3544622

0.098 0.062 CHEMBL3544791

0.102 0.057 CHEMBL1614639

0.114 0.046 CHEMBL3544790

0.093 0.068 CHEMBL3544623

0.096 0.064 CHEMBL3544625

0.114 0.045 CHEMBL3544626

0.143 0.027 CHEMBL1741437

CHEMBL1741437
0.0580.0250.083Potassium channel (Inward rectifier) blocker

0.055 0.028 CHEMBL6200

0.083 0.011 CHEMBL3544721

0.05 0.034 CHEMBL3544600

0.045 0.042 CHEMBL1741437

CHEMBL3544721
0.0980.0650.227GABA C receptor rho-1 antagonist

0.096 0.068 CHEMBL1190855

0.158 0.018 CHEMBL6200

0.097 0.066 CHEMBL3126023

0.12 0.04 CHEMBL3544719

0.091 0.076 CHEMBL578211

0.157 0.019 CHEMBL3544721

0.126 0.035 CHEMBL3544622

0.089 0.08 CHEMBL3544791

0.13 0.033 CHEMBL3544790

0.12 0.04 CHEMBL3544600

0.117 0.042 CHEMBL3544623

0.108 0.052 CHEMBL3544624

0.145 0.024 CHEMBL3544625

0.152 0.02 CHEMBL3544626

0.227 0.005 CHEMBL1741437

CHEMBL1741437
0.1180.0850.218Nav1.2 sodium channel blocker

0.218 0.029 CHEMBL3544721

0.17 0.047 CHEMBL3544622

0.131 0.072 CHEMBL3544600

CHEMBL3544721
0.0790.0470.079MAP kinase 7 inhibitor

0.074 0.069 CHEMBL1190855

0.1120.0790.135Cyclin-dependent kinase inhibitor

0.135 0.064 CHEMBL6200

0.118 0.075 CHEMBL3544719

CHEMBL6200
0.0390.0070.0395 Hydroxytryptamine 1F agonist

0.033 0.01 CHEMBL1190855

0.024 0.019 CHEMBL3544793

0.0840.0520.084CC chemokine 5 receptor agonist

0.082 0.058 CHEMBL1190855

0.084 0.05 CHEMBL6200

0.081 0.06 CHEMBL3544793

0.0960.0640.201Electrolyte absorption antagonist

0.103 0.054 CHEMBL6200

0.094 0.067 CHEMBL3126023

0.116 0.039 CHEMBL3544720

0.118 0.038 CHEMBL3544719

0.131 0.029 CHEMBL578211

0.089 0.075 CHEMBL3544622

0.096 0.063 CHEMBL3544791

0.158 0.016 CHEMBL3544599

0.106 0.049 CHEMBL3544621

0.163 0.015 CHEMBL3544790

0.14 0.024 CHEMBL3544623

0.142 0.023 CHEMBL3544625

0.194 0.009 CHEMBL3544626

0.201 0.008 CHEMBL1741437

CHEMBL1741437
0.0850.0550.119GABA A receptor agonist

0.081 0.061 CHEMBL6200

0.119 0.025 CHEMBL3544624

0.092 0.046 CHEMBL1741437

CHEMBL3544624
0.0760.0450.076MAP3K7 inhibitor

0.067 0.059 CHEMBL1190855

0.068 0.058 CHEMBL6200

0.0720.0420.125CDC7 inhibitor

0.125 0.014 CHEMBL6200

0.112 0.018 CHEMBL3544719

0.066 0.049 CHEMBL578211

CHEMBL6200
0.0910.0610.198Protein kinase C delta inhibitor

0.096 0.056 CHEMBL3544718

0.156 0.019 CHEMBL6200

0.087 0.066 CHEMBL3544720

0.088 0.065 CHEMBL3544621

0.158 0.018 CHEMBL3544624

0.198 0.009 CHEMBL3544625

0.099 0.053 CHEMBL3544626

0.083 0.073 CHEMBL1741437

CHEMBL3544625
0.0420.0140.046Ceramide glucosyltransferase inhibitor

0.034 0.028 CHEMBL1190855

0.032 0.031 CHEMBL6200

0.034 0.028 CHEMBL3544704

0.035 0.025 CHEMBL3544720

0.041 0.016 CHEMBL3544721

0.035 0.026 CHEMBL3544622

0.035 0.026 CHEMBL1614639

0.04 0.017 CHEMBL3544790

0.046 0.01 CHEMBL3544600

0.037 0.023 CHEMBL3544623

CHEMBL3544600
0.1130.0850.426Alpha-N-acetylglucosaminidase inhibitor

0.128 0.07 CHEMBL1190855

0.158 0.051 CHEMBL6200

0.148 0.056 CHEMBL3544704

0.12 0.078 CHEMBL3126023

0.16 0.049 CHEMBL3544719

0.114 0.083 CHEMBL578211

0.116 0.082 CHEMBL3544622

0.13 0.068 CHEMBL3544791

0.135 0.065 CHEMBL3544621

0.2 0.034 CHEMBL1614639

0.269 0.02 CHEMBL3544790

0.108 0.091 CHEMBL3544600

0.23 0.027 CHEMBL3544598

0.293 0.017 CHEMBL3544623

0.15 0.055 CHEMBL3544624

0.269 0.02 CHEMBL3544625

0.304 0.016 CHEMBL3544626

0.426 0.008 CHEMBL1741437

CHEMBL1741437
0.1050.0770.186Interleukin 2 antagonist

0.134 0.029 CHEMBL3544719

0.111 0.061 CHEMBL578211

0.186 0.009 CHEMBL3544624

0.099 0.097 CHEMBL3544625

0.105 0.077 CHEMBL1741437

CHEMBL3544624
0.0370.010.092DNA topoisomerase IV inhibitor

0.029 0.025 CHEMBL3544718

0.092 0.004 CHEMBL6200

0.034 0.013 CHEMBL3126023

0.053 0.005 CHEMBL3544719

0.037 0.01 CHEMBL578211

0.031 0.019 CHEMBL3544621

CHEMBL6200
0.0630.0370.073Potassium channel intermediate-conductance Ca-activated blocker

0.073 0.024 CHEMBL3544622

0.055 0.053 CHEMBL3544790

0.057 0.047 CHEMBL3544626

0.06 0.041 CHEMBL1741437

CHEMBL3544622
0.2450.220.522Apoptosis agonist

0.32 0.158 CHEMBL1190855

0.447 0.093 CHEMBL3544704

0.281 0.186 CHEMBL3544791

0.309 0.166 CHEMBL3559662

0.249 0.215 CHEMBL3544793

0.244 0.221 CHEMBL3544621

0.263 0.201 CHEMBL1614639

0.522 0.068 CHEMBL3544598

0.462 0.087 CHEMBL3544624

0.472 0.083 CHEMBL3544625

CHEMBL3544598
0.1040.0780.104Calcium channel (voltage-sensitive) blocker
0.1070.0820.107Calcium channel N-type blocker
0.0520.0270.095Dopamine beta hydroxylase inhibitor

0.047 0.037 CHEMBL1190855

0.051 0.028 CHEMBL6200

0.046 0.04 CHEMBL3126023

0.045 0.043 CHEMBL3544720

0.051 0.028 CHEMBL3544721

0.049 0.033 CHEMBL3544622

0.052 0.027 CHEMBL3544790

0.048 0.036 CHEMBL3544623

0.054 0.023 CHEMBL3544625

0.095 0.004 CHEMBL3544626

0.088 0.004 CHEMBL1741437

CHEMBL3544626
0.1720.1480.329RNA-directed DNA polymerase inhibitor

0.22 0.074 CHEMBL1190855

0.178 0.136 CHEMBL6200

0.308 0.03 CHEMBL3544704

0.182 0.129 CHEMBL3126023

0.176 0.14 CHEMBL3544720

0.196 0.106 CHEMBL3544719

0.186 0.123 CHEMBL578211

0.225 0.069 CHEMBL3544622

0.234 0.061 CHEMBL3544791

0.329 0.027 CHEMBL3559662

0.189 0.116 CHEMBL3544599

0.201 0.098 CHEMBL3544621

0.217 0.078 CHEMBL1614639

0.229 0.065 CHEMBL3544790

0.207 0.09 CHEMBL3544598

0.191 0.113 CHEMBL3544623

0.192 0.113 CHEMBL3544624

0.186 0.121 CHEMBL3544625

0.259 0.044 CHEMBL3544626

0.274 0.038 CHEMBL1741437

CHEMBL3559662
0.0740.050.084Alpha 1b adrenoreceptor antagonist

0.084 0.043 CHEMBL1190855

CHEMBL1190855
0.0570.0330.07Acetylcholine M2 receptor agonist

0.053 0.039 CHEMBL1190855

0.064 0.025 CHEMBL3544719

0.07 0.019 CHEMBL578211

0.067 0.022 CHEMBL3544791

0.06 0.028 CHEMBL3544793

CHEMBL578211
0.0860.0620.1Interleukin-1 receptor-associated protein kinase 4 inhibitor

0.1 0.046 CHEMBL6200

0.091 0.056 CHEMBL3544719

0.09 0.057 CHEMBL578211

CHEMBL6200
0.0940.070.187Nitric-oxide synthase inhibitor

0.172 0.015 CHEMBL6200

0.092 0.074 CHEMBL3544719

0.187 0.012 CHEMBL3544721

0.102 0.057 CHEMBL3544622

0.089 0.079 CHEMBL3544600

0.087 0.084 CHEMBL3544623

0.09 0.078 CHEMBL3544625

0.13 0.032 CHEMBL3544626

0.103 0.055 CHEMBL1741437

CHEMBL3544721
0.0360.0120.036CDK4/cyclin D3 inhibitor
0.0610.0390.085Potassium channel (Ca-activated) blocker

0.085 0.015 CHEMBL1190855

CHEMBL1190855
0.0720.0490.088Phospholipase D inhibitor

0.072 0.048 CHEMBL1190855

0.083 0.03 CHEMBL6200

0.081 0.032 CHEMBL3544719

0.08 0.034 CHEMBL3544721

0.082 0.031 CHEMBL3544790

0.068 0.058 CHEMBL3544600

0.082 0.031 CHEMBL3544623

0.075 0.042 CHEMBL3544625

0.088 0.024 CHEMBL3544626

0.082 0.031 CHEMBL1741437

CHEMBL3544626
0.0570.0350.084Pim-2 kinase inhibitor

0.084 0.019 CHEMBL6200

CHEMBL6200
0.0990.0780.151GABA receptor agonist

0.116 0.06 CHEMBL3544718

0.091 0.088 CHEMBL6200

0.111 0.066 CHEMBL578211

0.095 0.084 CHEMBL3544721

0.091 0.088 CHEMBL3544599

0.122 0.054 CHEMBL3544790

0.104 0.073 CHEMBL3544600

0.148 0.037 CHEMBL3544624

0.134 0.046 CHEMBL3544626

0.151 0.035 CHEMBL1741437

CHEMBL1741437
0.0370.0160.037Protein kinase (CK2) beta inhibitor

0.037 0.016 CHEMBL6200

0.032 0.027 CHEMBL3544720

0.035 0.018 CHEMBL3544719

0.035 0.019 CHEMBL1741437

0.060.0390.069Cyclin A1 inhibitor

0.069 0.023 CHEMBL6200

0.059 0.041 CHEMBL3544719

0.056 0.047 CHEMBL578211

CHEMBL6200
0.0420.0220.047Vascular adhesion protein 1 inhibitor

0.038 0.028 CHEMBL6200

0.044 0.02 CHEMBL3544719

0.047 0.018 CHEMBL578211

CHEMBL578211
0.0730.0540.085Phosphodiesterase VI inhibitor

0.081 0.04 CHEMBL3544719

0.085 0.033 CHEMBL578211

0.068 0.066 CHEMBL3544599

0.074 0.051 CHEMBL3544600

0.075 0.05 CHEMBL3544626

0.07 0.062 CHEMBL1741437

CHEMBL578211
0.0980.0790.332Cystathionine beta-synthase inhibitor

0.12 0.058 CHEMBL3126023

0.105 0.071 CHEMBL3544720

0.116 0.061 CHEMBL3544719

0.123 0.056 CHEMBL578211

0.103 0.073 CHEMBL3544721

0.171 0.032 CHEMBL3544622

0.097 0.08 CHEMBL3544791

0.131 0.05 CHEMBL3544599

0.149 0.041 CHEMBL1614639

0.332 0.007 CHEMBL3544790

0.109 0.067 CHEMBL3544600

0.117 0.06 CHEMBL3544598

0.167 0.034 CHEMBL3544623

0.147 0.042 CHEMBL3544624

0.262 0.013 CHEMBL3544625

0.295 0.01 CHEMBL3544626

0.262 0.014 CHEMBL1741437

CHEMBL3544790
0.0720.0530.107Rho-associated kinase inhibitor

0.107 0.032 CHEMBL6200

CHEMBL6200
0.1360.1180.282Tumour necrosis factor antagonist

0.228 0.039 CHEMBL6200

0.282 0.022 CHEMBL3544719

0.174 0.072 CHEMBL578211

0.189 0.06 CHEMBL3544622

0.189 0.06 CHEMBL3544793

0.161 0.087 CHEMBL3544621

0.153 0.097 CHEMBL3544790

0.169 0.078 CHEMBL3544600

0.174 0.073 CHEMBL3544624

0.165 0.082 CHEMBL3544625

0.166 0.081 CHEMBL3544626

0.155 0.094 CHEMBL1741437

CHEMBL3544719
0.0530.0360.053Dipeptidyl peptidase inhibitor

0.052 0.038 CHEMBL1190855

0.051 0.039 CHEMBL6200

0.0310.0140.031HCV NS5A inhibitor

0.029 0.017 CHEMBL1190855

0.03 0.015 CHEMBL6200

0.060.0440.134Adrenaline uptake inhibitor

0.069 0.036 CHEMBL3544718

0.068 0.036 CHEMBL1190855

0.07 0.034 CHEMBL6200

0.134 0.011 CHEMBL3544721

CHEMBL3544721
0.0730.0570.102Alpha 1 adrenoreceptor antagonist

0.102 0.043 CHEMBL1190855

CHEMBL1190855
0.020.0040.023Cyclin D2 inhibitor

0.013 0.011 CHEMBL3544718

0.014 0.008 CHEMBL1190855

0.023 0.003 CHEMBL6200

0.017 0.004 CHEMBL3126023

0.02 0.004 CHEMBL3544719

0.019 0.004 CHEMBL578211

0.013 0.009 CHEMBL3544791

0.015 0.006 CHEMBL3544621

CHEMBL6200
0.0540.0380.063Lysine-specific demethylase 1A inhibitor

0.063 0.024 CHEMBL6200

CHEMBL6200
0.0680.0530.128Benzodiazepine agonist

0.065 0.059 CHEMBL6200

0.082 0.037 CHEMBL578211

0.128 0.013 CHEMBL3544793

CHEMBL3544793
0.0670.0520.091Alpha 1a adrenoreceptor antagonist

0.091 0.04 CHEMBL1190855

CHEMBL1190855
0.0440.0290.194Glutamate (mGluR group III) antagonist

0.04 0.038 CHEMBL6200

0.045 0.028 CHEMBL3126023

0.055 0.016 CHEMBL3544719

0.067 0.01 CHEMBL578211

0.046 0.026 CHEMBL3544721

0.088 0.006 CHEMBL3544622

0.042 0.035 CHEMBL3544791

0.042 0.035 CHEMBL3544793

0.044 0.03 CHEMBL3544599

0.171 0.003 CHEMBL3544790

0.046 0.026 CHEMBL3544600

0.076 0.008 CHEMBL3544623

0.063 0.012 CHEMBL3544625

0.194 0.003 CHEMBL3544626

0.165 0.004 CHEMBL1741437

CHEMBL3544626
0.0550.0410.071Bruton tyrosine kinase inhibitor

0.071 0.025 CHEMBL1190855

CHEMBL1190855
0.0870.0750.087Phosphodiesterase 7B inhibitor

0.085 0.078 CHEMBL6200

0.084 0.081 CHEMBL578211

0.0560.0440.056Calcium channel T-type blocker
0.0530.0410.057Sphingosine kinase 2 inhibitor

0.057 0.036 CHEMBL6200

CHEMBL6200
0.1090.0980.206DNA repair enzyme inhibitor

0.114 0.085 CHEMBL6200

0.196 0.009 CHEMBL3544704

0.107 0.104 CHEMBL3544719

0.116 0.081 CHEMBL3544721

0.116 0.081 CHEMBL3544622

0.144 0.037 CHEMBL3559662

0.12 0.071 CHEMBL1614639

0.124 0.064 CHEMBL3544790

0.206 0.008 CHEMBL3544598

CHEMBL3544598
0.030.0190.035MAP3K8 inhibitor

0.035 0.011 CHEMBL6200

0.028 0.022 CHEMBL1741437

CHEMBL6200
0.0810.070.193Antiadrenergic

0.088 0.064 CHEMBL1190855

0.193 0.026 CHEMBL3544623

CHEMBL3544623
0.0270.0160.028Calcitonin gene-related peptide antagonist

0.028 0.016 CHEMBL1190855

CHEMBL1190855
0.1090.0990.155Sodium channel (voltage-gated) blocker

0.108 0.1 CHEMBL3544718

0.155 0.051 CHEMBL6200

0.135 0.067 CHEMBL3544719

CHEMBL6200
0.0440.0340.0445 Hydroxytryptamine 1A agonist
0.0740.0650.088MAP kinase kinase 7 inhibitor

0.088 0.029 CHEMBL6200

0.076 0.058 CHEMBL3544720

CHEMBL6200
0.0310.0220.064CXC chemokine 3 receptor antagonist

0.031 0.022 CHEMBL1190855

0.063 0.007 CHEMBL578211

0.064 0.006 CHEMBL3544791

0.037 0.016 CHEMBL3544793

0.028 0.026 CHEMBL3544621

CHEMBL3544791
0.0280.0180.028Sigma 1 receptor antagonist

0.024 0.02 CHEMBL1190855

0.0340.0250.034Opioid delta receptor agonist

0.032 0.03 CHEMBL1190855

0.0380.0290.038Cyclin D3 inhibitor

0.034 0.032 CHEMBL6200

0.0330.0250.035CDK6/cyclin D3 inhibitor

0.035 0.022 CHEMBL6200

0.033 0.024 CHEMBL3544719

0.032 0.026 CHEMBL578211

CHEMBL6200
0.1650.1580.277Cardiotonic

0.277 0.067 CHEMBL1614639

0.224 0.1 CHEMBL3544623

0.193 0.125 CHEMBL3544624

0.185 0.134 CHEMBL3544626

CHEMBL1614639
0.0440.0370.057Glycine transporter inhibitor

0.057 0.026 CHEMBL1190855

0.043 0.037 CHEMBL6200

CHEMBL1190855
0.0650.0580.112CXC chemokine receptor antagonist

0.08 0.037 CHEMBL3544719

0.086 0.033 CHEMBL578211

0.065 0.057 CHEMBL3544791

0.112 0.019 CHEMBL3544793

CHEMBL3544793
0.0230.0170.023Dopamine autoreceptor agonist
0.050.0440.096Protein kinase C eta inhibitor

0.082 0.023 CHEMBL1190855

0.054 0.039 CHEMBL3544704

0.079 0.024 CHEMBL3544720

0.07 0.029 CHEMBL3544791

0.068 0.029 CHEMBL3544599

0.096 0.018 CHEMBL3544621

0.051 0.042 CHEMBL1614639

0.093 0.019 CHEMBL3544624

CHEMBL3544621
0.0160.010.017CXC chemokine 4 receptor agonist

0.017 0.008 CHEMBL6200

0.014 0.013 CHEMBL3544719

0.014 0.012 CHEMBL578211

0.014 0.012 CHEMBL3544622

CHEMBL6200
0.0870.0820.093Insulin receptor antagonist

0.093 0.072 CHEMBL578211

CHEMBL578211
0.0370.0310.042MAP3K5 inhibitor

0.042 0.022 CHEMBL6200

0.038 0.029 CHEMBL3544719

0.036 0.032 CHEMBL578211

CHEMBL6200
0.0370.0320.045Protein kinase (CK1) epsilon inhibitor

0.045 0.018 CHEMBL6200

CHEMBL6200
0.0750.0710.174Inducible nitric-oxide synthase inhibitor

0.174 0.012 CHEMBL6200

0.078 0.065 CHEMBL3544719

0.148 0.017 CHEMBL3544721

0.075 0.072 CHEMBL3544622

0.107 0.032 CHEMBL3544623

0.101 0.036 CHEMBL3544625

0.13 0.021 CHEMBL3544626

0.108 0.031 CHEMBL1741437

CHEMBL6200
0.0250.0210.031Acid ceramidase inhibitor

0.031 0.008 CHEMBL1190855

0.027 0.014 CHEMBL3544721

0.026 0.017 CHEMBL3544791

CHEMBL1190855
0.0710.0670.108Leucine-rich repeat kinase 2 inhibitor

0.087 0.052 CHEMBL6200

0.108 0.038 CHEMBL3544719

CHEMBL3544719
0.0460.0430.069Prolyl endopeptidase inhibitor

0.05 0.036 CHEMBL3544622

0.052 0.034 CHEMBL3544790

0.054 0.03 CHEMBL3544600

0.069 0.016 CHEMBL3544626

0.05 0.036 CHEMBL1741437

CHEMBL3544626
0.0170.0140.023Histamine H4 receptor agonist

0.018 0.013 CHEMBL6200

0.023 0.009 CHEMBL3544721

CHEMBL3544721
0.0750.0720.191Adrenaline antagonist

0.082 0.066 CHEMBL1190855

0.191 0.025 CHEMBL3544623

CHEMBL3544623
0.0390.0370.059GABA B receptor antagonist

0.039 0.037 CHEMBL1190855

0.058 0.013 CHEMBL6200

0.059 0.013 CHEMBL3544790

0.047 0.023 CHEMBL3544626

0.049 0.021 CHEMBL1741437

CHEMBL3544790
0.0510.0480.064Alpha 1d adrenoreceptor antagonist

0.064 0.038 CHEMBL1190855

CHEMBL1190855
0.0550.0520.058Cyclin A2 inhibitor

0.058 0.048 CHEMBL6200

CHEMBL6200
0.0410.0390.041Dipeptidyl peptidase IV inhibitor
0.2430.2420.285MAP kinase 1 inhibitor

0.253 0.229 CHEMBL6200

0.285 0.198 CHEMBL3544719

0.276 0.206 CHEMBL578211

CHEMBL3544719
0.0160.0140.016Calcitonin gene-related peptide 1 receptor antagonist

0.016 0.013 CHEMBL1190855

0.016 0.014 CHEMBL3544719

0.0540.0520.124Glutamate (mGluR) agonist

0.124 0.018 CHEMBL578211

0.059 0.046 CHEMBL3544622

0.08 0.031 CHEMBL3544791

0.092 0.026 CHEMBL3544790

0.075 0.033 CHEMBL3544626

0.086 0.028 CHEMBL1741437

CHEMBL578211
0.0460.0460.087Protein kinase C epsilon inhibitor

0.087 0.016 CHEMBL6200

0.047 0.044 CHEMBL3544719

0.047 0.046 CHEMBL3544621

CHEMBL6200
0.0270.0270.03Dipeptidyl peptidase I inhibitor

0.029 0.023 CHEMBL1190855

0.028 0.025 CHEMBL578211

0.03 0.022 CHEMBL3544791

CHEMBL3544791
0.0350.0350.191Histone deacetylase 9 inhibitor

0.048 0.017 CHEMBL3544719

0.042 0.023 CHEMBL578211

0.156 0.004 CHEMBL3544721

0.067 0.01 CHEMBL3544622

0.039 0.027 CHEMBL3544791

0.06 0.012 CHEMBL3544793

0.045 0.02 CHEMBL3544790

0.191 0.004 CHEMBL3544600

0.05 0.016 CHEMBL3544625

0.041 0.024 CHEMBL3544626

CHEMBL3544600
0.0320.0330.033Adenosine uptake inhibitor

0.033 0.03 CHEMBL578211

0.033 0.032 CHEMBL3544791

CHEMBL3544791
0.0390.040.236Glutamate (mGluR4) antagonist

0.052 0.019 CHEMBL6200

0.054 0.017 CHEMBL3544719

0.041 0.034 CHEMBL578211

0.058 0.015 CHEMBL3544721

0.114 0.005 CHEMBL3544622

0.203 0.003 CHEMBL3544790

0.055 0.017 CHEMBL3544600

0.077 0.009 CHEMBL3544623

0.08 0.008 CHEMBL3544625

0.236 0.003 CHEMBL3544626

0.197 0.003 CHEMBL1741437

CHEMBL3544626
0.0630.0640.178Aminopeptidase I inhibitor

0.068 0.057 CHEMBL6200

0.071 0.052 CHEMBL3544721

0.103 0.026 CHEMBL3544622

0.135 0.015 CHEMBL3544790

0.066 0.059 CHEMBL3544600

0.133 0.016 CHEMBL3544623

0.129 0.017 CHEMBL3544625

0.178 0.009 CHEMBL3544626

0.155 0.012 CHEMBL1741437

CHEMBL3544626
0.0420.0430.063Aldosterone antagonist

0.049 0.03 CHEMBL6200

0.047 0.034 CHEMBL3544719

0.062 0.018 CHEMBL3544790

0.063 0.018 CHEMBL3544624

CHEMBL3544624
0.1450.1460.301Neurotrophic factor enhancer

0.152 0.135 CHEMBL3544720

0.208 0.069 CHEMBL3544721

0.217 0.061 CHEMBL3544622

0.282 0.024 CHEMBL3544790

0.221 0.058 CHEMBL3544600

0.229 0.052 CHEMBL3544623

0.244 0.042 CHEMBL3544624

0.194 0.083 CHEMBL3544625

0.301 0.018 CHEMBL3544626

0.252 0.037 CHEMBL1741437

CHEMBL3544626
0.0370.0390.065Guanylate cyclase inhibitor

0.065 0.008 CHEMBL3544704

0.048 0.023 CHEMBL1741437

CHEMBL3544704
0.0290.0320.045ATR kinase inhibitor

0.045 0.009 CHEMBL6200

0.031 0.026 CHEMBL3544719

CHEMBL6200
0.0350.0370.061Glutamate (mGluR1a) antagonist

0.061 0.014 CHEMBL6200

0.042 0.027 CHEMBL3544719

0.037 0.033 CHEMBL578211

0.038 0.032 CHEMBL3544721

CHEMBL6200
0.0240.0270.031Myristoyl transferase inhibitor

0.027 0.02 CHEMBL6200

0.031 0.012 CHEMBL3544721

0.026 0.022 CHEMBL3544626

CHEMBL3544721
0.1230.1260.157MAP kinase 3 inhibitor

0.134 0.097 CHEMBL6200

0.13 0.106 CHEMBL3544719

0.157 0.057 CHEMBL1741437

CHEMBL1741437
0.0520.0550.076Pregnane X receptor antagonist

0.055 0.044 CHEMBL6200

0.058 0.036 CHEMBL3544719

0.053 0.051 CHEMBL578211

0.06 0.032 CHEMBL3544793

0.069 0.015 CHEMBL3544790

0.072 0.012 CHEMBL3544623

0.074 0.01 CHEMBL3544625

0.076 0.009 CHEMBL3544626

0.074 0.01 CHEMBL1741437

CHEMBL3544626
0.0490.0530.131CXC chemokine 4 receptor antagonist

0.131 0.019 CHEMBL6200

0.065 0.039 CHEMBL3544719

0.066 0.038 CHEMBL3544721

CHEMBL6200
0.0210.0250.023Phosphodiesterase 9A inhibitor

0.023 0.019 CHEMBL6200

0.023 0.02 CHEMBL3544719

CHEMBL3544719
0.0510.0550.1175 Hydroxytryptamine uptake inhibitor

0.059 0.048 CHEMBL1190855

0.06 0.046 CHEMBL6200

0.117 0.021 CHEMBL3544721

CHEMBL3544721
0.0090.0140.018Egl nine homolog 3 inhibitor

0.013 0.008 CHEMBL3544626

0.018 0.004 CHEMBL1741437

CHEMBL1741437
0.1160.1220.271Hemostatic

0.124 0.106 CHEMBL3544704

0.123 0.109 CHEMBL3544719

0.12 0.113 CHEMBL3544721

0.153 0.064 CHEMBL3544622

0.161 0.056 CHEMBL3544790

0.271 0.019 CHEMBL3544598

0.125 0.104 CHEMBL3544624

0.193 0.035 CHEMBL3544626

0.176 0.045 CHEMBL1741437

CHEMBL3544598
0.1380.1440.16Ca2+/calmodulin-dependent kinase II beta inhibitor

0.16 0.115 CHEMBL1190855

0.158 0.118 CHEMBL3544791

CHEMBL1190855
0.080.0870.133Sphingomyelinase inhibitor

0.133 0.033 CHEMBL3544721

0.126 0.037 CHEMBL3544600

0.127 0.036 CHEMBL3544623

0.085 0.08 CHEMBL3544626

CHEMBL3544721
0.0280.0360.041Carnitine palmitoyltransferase 1 inhibitor

0.041 0.014 CHEMBL1741437

CHEMBL1741437
0.120.1280.144Interleukin-1 receptor-associated protein kinase 1 inhibitor

0.144 0.1 CHEMBL6200

CHEMBL6200
0.0040.0120.006CC chemokine 6 receptor agonist

0.006 0.005 CHEMBL6200

CHEMBL6200
0.0810.0890.237Lanosterol 14 alpha demethylase inhibitor

0.116 0.035 CHEMBL6200

0.118 0.033 CHEMBL3544719

0.092 0.069 CHEMBL3544721

0.127 0.024 CHEMBL3544790

0.237 0.004 CHEMBL3544623

0.095 0.064 CHEMBL3544624

0.138 0.017 CHEMBL3544625

0.199 0.004 CHEMBL3544626

0.187 0.005 CHEMBL1741437

CHEMBL3544623
0.0390.0470.056Heme oxygenase inhibitor

0.046 0.021 CHEMBL3544790

0.049 0.015 CHEMBL3544623

0.041 0.039 CHEMBL3544625

0.056 0.008 CHEMBL3544626

0.046 0.019 CHEMBL1741437

CHEMBL3544626
0.0040.0130.011Integrin alpha5beta6 antagonist

0.007 0.004 CHEMBL3544790

0.007 0.005 CHEMBL3544623

0.007 0.005 CHEMBL3544625

0.009 0.003 CHEMBL3544626

0.011 0.003 CHEMBL1741437

CHEMBL1741437
0.030.0390.041Protein kinase C beta I inhibitor

0.041 0.008 CHEMBL1190855

0.036 0.015 CHEMBL3544704

0.039 0.01 CHEMBL3544791

0.038 0.011 CHEMBL3544621

CHEMBL1190855
0.0990.110.149Transcription factor STAT6 inhibitor

0.104 0.096 CHEMBL3544721

0.149 0.024 CHEMBL3544622

0.123 0.055 CHEMBL3544600

0.127 0.048 CHEMBL3544625

0.114 0.072 CHEMBL3544626

0.105 0.094 CHEMBL1741437

CHEMBL3544622
0.0830.0930.091Nav1.1 sodium channel blocker

0.091 0.078 CHEMBL3544721

CHEMBL3544721
0.1390.1490.201Focal adhesion kinase 2 inhibitor

0.191 0.076 CHEMBL6200

0.201 0.069 CHEMBL3544719

0.157 0.12 CHEMBL578211

CHEMBL3544719
0.0270.0380.041Carnitine palmitoyltransferase inhibitor

0.032 0.027 CHEMBL3544626

0.041 0.014 CHEMBL1741437

CHEMBL1741437
0.0330.0440.054Neurokinin 1 antagonist

0.037 0.035 CHEMBL1190855

0.054 0.017 CHEMBL6200

CHEMBL6200
0.0320.0430.093Dopamine D5 agonist

0.036 0.034 CHEMBL1190855

0.093 0.005 CHEMBL6200

0.037 0.032 CHEMBL3544719

CHEMBL6200
0.0310.0420.06Substance P antagonist

0.06 0.012 CHEMBL6200

CHEMBL6200
0.0150.0270.025Imidazoline I1 receptor antagonist

0.025 0.01 CHEMBL6200

CHEMBL6200
0.0150.0270.023Alpha 2b adrenoreceptor agonist

0.023 0.007 CHEMBL6200

CHEMBL6200
0.0090.0220.066Egl nine homolog 1 inhibitor

0.033 0.004 CHEMBL3544790

0.045 0.003 CHEMBL3544626

0.066 0.003 CHEMBL1741437

CHEMBL1741437
0.0410.0540.046Benzodiazepine antagonist

0.046 0.035 CHEMBL3544721

CHEMBL3544721
0.0120.0250.021Cyclin T1 inhibitor

0.021 0.009 CHEMBL6200

CHEMBL6200
0.0230.0370.032Glucosylceramidase stimulant

0.026 0.025 CHEMBL6200

0.032 0.009 CHEMBL3544719

0.029 0.014 CHEMBL578211

0.028 0.018 CHEMBL3544721

0.029 0.015 CHEMBL3544600

0.028 0.016 CHEMBL3544626

0.027 0.019 CHEMBL1741437

CHEMBL3544719
0.0140.0280.019Complement factor D inhibitor

0.019 0.011 CHEMBL6200

0.019 0.01 CHEMBL1741437

CHEMBL1741437
0.0770.0910.093MAP kinase kinase kinase inhibitor

0.093 0.073 CHEMBL6200

CHEMBL6200
0.0230.0370.03Hedgehog signaling activator

0.026 0.024 CHEMBL1614639

0.03 0.013 CHEMBL3544626

CHEMBL3544626
0.0350.0490.1Geranyltranstransferase inhibitor

0.043 0.031 CHEMBL1190855

0.057 0.016 CHEMBL6200

0.065 0.01 CHEMBL3544721

0.045 0.028 CHEMBL3544622

0.063 0.011 CHEMBL3544790

0.04 0.037 CHEMBL3544600

0.052 0.021 CHEMBL3544623

0.051 0.021 CHEMBL3544624

0.058 0.015 CHEMBL3544625

0.1 0.004 CHEMBL3544626

0.091 0.004 CHEMBL1741437

CHEMBL3544626
0.0090.0240.018Somatostatin 2 agonist

0.018 0.007 CHEMBL6200

CHEMBL6200
0.0460.0610.076Protein kinase C theta inhibitor

0.072 0.021 CHEMBL6200

0.076 0.017 CHEMBL3544625

CHEMBL3544625
0.0870.1020.222GABA C receptor antagonist

0.154 0.028 CHEMBL6200

0.109 0.065 CHEMBL3544719

0.139 0.037 CHEMBL3544721

0.123 0.05 CHEMBL3544622

0.129 0.044 CHEMBL3544790

0.103 0.073 CHEMBL3544600

0.118 0.055 CHEMBL3544623

0.156 0.027 CHEMBL3544624

0.143 0.034 CHEMBL3544625

0.15 0.03 CHEMBL3544626

0.222 0.009 CHEMBL1741437

CHEMBL1741437
0.0390.0550.143Dopamine D4 agonist

0.143 0.01 CHEMBL3544793

CHEMBL3544793
0.0070.0240.01Imidazoline I2 receptor antagonist

0.01 0.009 CHEMBL6200

CHEMBL6200
0.0420.0590.054Cytokine production stimulant

0.048 0.035 CHEMBL3544721

0.05 0.028 CHEMBL3544622

0.048 0.035 CHEMBL3544626

0.054 0.021 CHEMBL1741437

CHEMBL1741437
0.0440.0610.136Mannitol-1-phosphate 5-dehydrogenase inhibitor

0.056 0.04 CHEMBL6200

0.086 0.018 CHEMBL3544704

0.052 0.044 CHEMBL3126023

0.053 0.044 CHEMBL3544720

0.063 0.032 CHEMBL3544719

0.05 0.049 CHEMBL578211

0.051 0.046 CHEMBL3544622

0.086 0.018 CHEMBL3559662

0.059 0.035 CHEMBL3544599

0.053 0.043 CHEMBL3544621

0.077 0.022 CHEMBL1614639

0.089 0.017 CHEMBL3544790

0.063 0.032 CHEMBL3544598

0.092 0.016 CHEMBL3544623

0.077 0.022 CHEMBL3544624

0.085 0.018 CHEMBL3544625

0.095 0.015 CHEMBL3544626

0.136 0.009 CHEMBL1741437

CHEMBL1741437
0.0780.0960.162Interleukin 1 beta converting enzyme inhibitor

0.124 0.032 CHEMBL1190855

0.095 0.064 CHEMBL578211

0.086 0.08 CHEMBL3544721

0.142 0.021 CHEMBL3544791

0.149 0.017 CHEMBL3544790

0.096 0.063 CHEMBL3544600

0.117 0.038 CHEMBL3544623

0.115 0.04 CHEMBL3544625

0.162 0.013 CHEMBL3544626

0.138 0.023 CHEMBL1741437

CHEMBL3544626
0.0270.0450.123Dopamine D3 agonist

0.123 0.005 CHEMBL3544624

CHEMBL3544624
0.0890.1080.098CDC-like kinase 3 inhibitor

0.096 0.088 CHEMBL578211

0.098 0.083 CHEMBL3544599

CHEMBL3544599
0.0570.0770.112Rho-associated kinase I inhibitor

0.112 0.024 CHEMBL6200

CHEMBL6200
0.0330.0530.049Plasmepsin II inhibitor

0.047 0.02 CHEMBL6200

0.049 0.019 CHEMBL3544719

0.04 0.03 CHEMBL3544626

CHEMBL3544719
0.0210.0410.03Carnitine palmitoyltransferase 1A inhibitor

0.03 0.018 CHEMBL1741437

CHEMBL1741437
0.0150.0350.051Glutamate (mGluR1a) agonist

0.02 0.018 CHEMBL6200

0.032 0.008 CHEMBL3544790

0.021 0.017 CHEMBL3544623

0.051 0.005 CHEMBL3544626

0.032 0.008 CHEMBL1741437

CHEMBL3544626
0.0080.0280.02Human herpes virus 5 capsid protein P40 inhibitor

0.02 0.004 CHEMBL3544793

CHEMBL3544793
0.020.0410.033Endothelial nitric-oxide synthase inhibitor

0.033 0.02 CHEMBL6200

0.033 0.019 CHEMBL3544721

CHEMBL3544721
0.0290.050.05Tryptophan 5 hydroxylase inhibitor

0.034 0.03 CHEMBL6200

0.037 0.021 CHEMBL3544623

0.04 0.015 CHEMBL3544626

0.05 0.005 CHEMBL1741437

CHEMBL1741437
0.0740.0950.237Hematopoietic

0.128 0.019 CHEMBL3544719

0.086 0.057 CHEMBL578211

0.111 0.026 CHEMBL3544721

0.128 0.019 CHEMBL3544622

0.084 0.062 CHEMBL3544599

0.237 0.007 CHEMBL3544621

0.138 0.017 CHEMBL3544790

0.098 0.038 CHEMBL3544600

0.092 0.046 CHEMBL3544623

0.079 0.076 CHEMBL3544625

0.128 0.019 CHEMBL3544626

0.1 0.036 CHEMBL1741437

CHEMBL3544621
0.010.0310.036Steroid 17-alpha-hydroxylase/17,20 lyase inhibitor

0.018 0.015 CHEMBL6200

0.017 0.016 CHEMBL3544626

0.036 0.008 CHEMBL1741437

CHEMBL1741437
0.0120.0340.022Alpha 2c adrenoreceptor agonist

0.022 0.009 CHEMBL6200

CHEMBL6200
0.130.1520.144EphB2 antagonist

0.144 0.136 CHEMBL6200

CHEMBL6200
0.0290.0510.037Delayed rectifier potassium channel blocker

0.037 0.026 CHEMBL3544721

CHEMBL3544721
0.0390.0640.361Aconitate hydratase inhibitor

0.047 0.044 CHEMBL6200

0.048 0.043 CHEMBL3126023

0.05 0.039 CHEMBL3544719

0.049 0.041 CHEMBL3544721

0.082 0.013 CHEMBL3544622

0.048 0.042 CHEMBL3544621

0.352 0.002 CHEMBL3544790

0.047 0.045 CHEMBL3544600

0.322 0.002 CHEMBL3544623

0.082 0.013 CHEMBL3544624

0.301 0.002 CHEMBL3544625

0.361 0.002 CHEMBL3544626

0.257 0.003 CHEMBL1741437

CHEMBL3544626
0.1250.150.142Ca2+/calmodulin-dependent protein kinase inhibitor

0.135 0.13 CHEMBL1190855

0.142 0.12 CHEMBL3544721

CHEMBL3544721
0.0770.1030.095Glutamate release inhibitor

0.088 0.066 CHEMBL3544790

0.095 0.052 CHEMBL3544623

0.085 0.076 CHEMBL3544624

0.093 0.056 CHEMBL3544626

0.091 0.059 CHEMBL1741437

CHEMBL3544623
0.0380.0640.085Benzodiazepine inverse agonist

0.085 0.005 CHEMBL3544793

CHEMBL3544793
0.0270.0540.049Oxytocin agonist

0.044 0.028 CHEMBL3544719

0.049 0.024 CHEMBL3544622

CHEMBL3544622
0.0750.1020.083MAP kinase kinase 1 inhibitor

0.083 0.082 CHEMBL578211

CHEMBL578211
0.050.0770.135Cyclin B3 inhibitor

0.135 0.017 CHEMBL3544719

CHEMBL3544719
0.0590.0860.089MDM2 inhibitor

0.067 0.046 CHEMBL6200

0.078 0.023 CHEMBL3544719

0.069 0.04 CHEMBL578211

0.068 0.044 CHEMBL1614639

0.068 0.046 CHEMBL3544790

0.064 0.058 CHEMBL3544625

0.079 0.021 CHEMBL3544626

0.089 0.012 CHEMBL1741437

CHEMBL1741437
0.040.0680.163Bromodomain-containing protein 4 inhibitor

0.117 0.01 CHEMBL1190855

0.068 0.026 CHEMBL578211

0.163 0.005 CHEMBL3544791

CHEMBL3544791
0.0340.0620.053Bromodomain-containing protein 3 inhibitor

0.047 0.039 CHEMBL1190855

0.053 0.029 CHEMBL3544791

CHEMBL3544791
0.050.0790.059Ryanodine receptor antagonist

0.057 0.047 CHEMBL1190855

0.059 0.041 CHEMBL3544626

0.056 0.052 CHEMBL1741437

CHEMBL3544626
0.1680.1970.689Cholesterol antagonist

0.284 0.102 CHEMBL3544704

0.312 0.084 CHEMBL3544721

0.268 0.113 CHEMBL3544622

0.226 0.143 CHEMBL1614639

0.643 0.013 CHEMBL3544790

0.307 0.087 CHEMBL3544600

0.509 0.031 CHEMBL3544598

0.675 0.01 CHEMBL3544623

0.352 0.063 CHEMBL3544624

0.577 0.021 CHEMBL3544625

0.689 0.009 CHEMBL3544626

0.546 0.026 CHEMBL1741437

CHEMBL3544626
0.0380.0670.048Topoisomerase II beta inhibitor

0.048 0.036 CHEMBL6200

0.046 0.04 CHEMBL1741437

CHEMBL6200
0.1860.2150.393Interleukin 2 agonist

0.238 0.133 CHEMBL1190855

0.309 0.067 CHEMBL3544704

0.367 0.039 CHEMBL3544719

0.279 0.09 CHEMBL578211

0.321 0.06 CHEMBL3544791

0.316 0.063 CHEMBL3559662

0.27 0.098 CHEMBL3544793

0.2 0.19 CHEMBL3544599

0.254 0.114 CHEMBL3544621

0.243 0.127 CHEMBL1614639

0.288 0.082 CHEMBL3544790

0.393 0.029 CHEMBL3544598

0.361 0.041 CHEMBL3544623

0.273 0.095 CHEMBL3544625

0.353 0.044 CHEMBL3544626

0.391 0.03 CHEMBL1741437

CHEMBL3544598
0.0520.0810.796Porphobilinogen synthase inhibitor

0.082 0.046 CHEMBL6200

0.069 0.057 CHEMBL3544720

0.101 0.035 CHEMBL3544719

0.096 0.038 CHEMBL3544721

0.31 0.005 CHEMBL3544622

0.084 0.044 CHEMBL3544599

0.073 0.053 CHEMBL3544621

0.708 0.002 CHEMBL3544790

0.092 0.04 CHEMBL3544600

0.58 0.003 CHEMBL3544623

0.097 0.037 CHEMBL3544624

0.598 0.003 CHEMBL3544625

0.796 0.002 CHEMBL3544626

0.656 0.003 CHEMBL1741437

CHEMBL3544626
0.0580.0880.122Glycine receptor agonist

0.066 0.063 CHEMBL1614639

0.1 0.021 CHEMBL3544790

0.085 0.033 CHEMBL3544623

0.085 0.033 CHEMBL3544624

0.087 0.031 CHEMBL3544625

0.122 0.012 CHEMBL3544626

0.088 0.03 CHEMBL1741437

CHEMBL3544626
0.0250.0550.042Protein kinase C beta II inhibitor

0.042 0.009 CHEMBL1190855

0.03 0.029 CHEMBL3544704

0.039 0.012 CHEMBL3544791

0.035 0.017 CHEMBL3544621

CHEMBL1190855
0.0620.0930.086Vanilloid 4 agonist

0.086 0.031 CHEMBL3544626

CHEMBL3544626
0.1190.1490.233Pyruvate kinase inhibitor

0.143 0.121 CHEMBL3544622

0.233 0.067 CHEMBL3544790

0.166 0.102 CHEMBL3544625

0.151 0.114 CHEMBL3544626

0.142 0.122 CHEMBL1741437

CHEMBL3544790
0.0420.0740.087Protein kinase C iota inhibitor

0.087 0.023 CHEMBL6200

CHEMBL6200
0.0550.0870.088Secretase beta inhibitor

0.069 0.051 CHEMBL6200

0.088 0.027 CHEMBL3544719

0.074 0.043 CHEMBL578211

0.066 0.058 CHEMBL3544623

0.085 0.03 CHEMBL3544624

0.068 0.053 CHEMBL3544626

CHEMBL3544719
0.0760.1080.25Toll-Like receptor 3 antagonist

0.25 0.004 CHEMBL3544721

0.14 0.018 CHEMBL3544622

0.16 0.012 CHEMBL3544600

0.084 0.083 CHEMBL3544623

CHEMBL3544721
0.0490.0810.078Nav1.7 sodium channel blocker

0.078 0.035 CHEMBL6200

0.068 0.047 CHEMBL3544719

CHEMBL6200
0.0610.0940.08CDK/cyclin complex inhibitor

0.08 0.069 CHEMBL6200

CHEMBL6200
0.0150.0480.049Lysine carboxypeptidase inhibitor

0.035 0.013 CHEMBL3544790

0.032 0.014 CHEMBL3544623

0.03 0.015 CHEMBL3544625

0.049 0.008 CHEMBL3544626

0.035 0.013 CHEMBL1741437

CHEMBL3544626
0.0120.0450.02CXC chemokine 5 receptor antagonist

0.017 0.015 CHEMBL3544626

0.02 0.009 CHEMBL1741437

CHEMBL1741437
0.0510.0850.116Protein kinase C alpha inhibitor

0.076 0.037 CHEMBL1190855

0.086 0.03 CHEMBL6200

0.061 0.059 CHEMBL3544720

0.064 0.054 CHEMBL3544791

0.116 0.017 CHEMBL3544624

0.069 0.045 CHEMBL3544625

CHEMBL3544624
0.0130.0470.064Nicotinamide phosphoribosyltransferase inhibitor

0.028 0.02 CHEMBL3544721

0.064 0.01 CHEMBL3544625

CHEMBL3544625
0.0810.1150.118MAP kinase 13 inhibitor

0.118 0.058 CHEMBL6200

0.102 0.078 CHEMBL3544719

CHEMBL6200
0.0750.1090.17Protein kinase (CK2) alpha inhibitor

0.124 0.06 CHEMBL6200

0.11 0.069 CHEMBL3544719

0.125 0.059 CHEMBL3544626

0.17 0.032 CHEMBL1741437

CHEMBL1741437
0.040.0760.069Bombesin 3 receptor antagonist

0.052 0.043 CHEMBL6200

0.069 0.025 CHEMBL3544622

CHEMBL3544622
0.0720.1080.25Gastric antisecretory

0.246 0.007 CHEMBL3544721

0.169 0.019 CHEMBL3544622

0.222 0.009 CHEMBL3544790

0.25 0.006 CHEMBL3544600

0.198 0.013 CHEMBL3544623

0.2 0.012 CHEMBL3544625

0.173 0.018 CHEMBL3544626

0.125 0.04 CHEMBL1741437

CHEMBL3544600
0.1060.1430.121Heat shock protein 90 antagonist

0.121 0.112 CHEMBL3544719

0.12 0.114 CHEMBL3544622

CHEMBL3544719
0.0410.0780.075Glucosylceramidase inhibitor

0.063 0.028 CHEMBL6200

0.075 0.019 CHEMBL3544720

0.066 0.025 CHEMBL1614639

0.055 0.037 CHEMBL3544626

CHEMBL3544720
0.0330.0710.053Neurokinin antagonist

0.053 0.03 CHEMBL6200

CHEMBL6200
0.1720.210.459Vasodilator, coronary

0.459 0.022 CHEMBL3544704

0.41 0.032 CHEMBL3544721

0.285 0.1 CHEMBL3544622

0.333 0.064 CHEMBL3559662

0.207 0.176 CHEMBL1614639

0.339 0.061 CHEMBL3544790

0.274 0.111 CHEMBL3544600

0.355 0.053 CHEMBL3544598

0.33 0.066 CHEMBL3544623

0.228 0.156 CHEMBL3544624

0.377 0.043 CHEMBL3544625

0.364 0.049 CHEMBL3544626

0.31 0.079 CHEMBL1741437

CHEMBL3544704
0.0220.060.0755 Hydroxytryptamine 2C agonist

0.075 0.012 CHEMBL6200

0.049 0.029 CHEMBL3544719

CHEMBL6200
0.0810.1190.116Multidrug resistance-associated protein 1 inhibitor

0.116 0.053 CHEMBL3544598

CHEMBL3544598
0.0350.0740.058GABA receptor antagonist

0.058 0.034 CHEMBL6200

CHEMBL6200
0.0790.1180.11Glutamate (mGluR7) agonist

0.107 0.047 CHEMBL3544721

0.1 0.061 CHEMBL3544790

0.102 0.055 CHEMBL3544623

0.11 0.042 CHEMBL3544626

0.094 0.074 CHEMBL1741437

CHEMBL3544626
0.0210.060.027Thymidine kinase (Herpes simplex virus 1) inhibitor

0.025 0.023 CHEMBL3544704

0.026 0.02 CHEMBL3544719

0.027 0.017 CHEMBL1614639

CHEMBL1614639
0.0330.0720.049Transforming growth factor beta 1 antagonist

0.049 0.035 CHEMBL6200

CHEMBL6200
0.0030.0440.037Integrin alphaVbeta5 antagonist

0.037 0.003 CHEMBL3544626

0.028 0.004 CHEMBL1741437

CHEMBL3544626
0.0250.0650.059CDK5/p25 inhibitor

0.045 0.025 CHEMBL6200

0.059 0.016 CHEMBL3544719

CHEMBL3544719
0.0240.0640.066p53 inhibitor

0.037 0.023 CHEMBL3544719

0.033 0.028 CHEMBL578211

0.066 0.006 CHEMBL1741437

CHEMBL1741437
0.0240.0650.071DNA gyrase subunit B inhibitor

0.054 0.011 CHEMBL6200

0.039 0.024 CHEMBL3544719

0.036 0.03 CHEMBL3544790

0.071 0.006 CHEMBL3544623

0.047 0.015 CHEMBL3544626

0.037 0.028 CHEMBL1741437

CHEMBL3544623
0.0810.1220.335Proto-oncogene tyrosine-protein kinase Yes inhibitor

0.335 0.012 CHEMBL3544718

CHEMBL3544718
0.0470.0880.056Enoyl-[acyl-carrier-protein] reductase inhibitor

0.056 0.053 CHEMBL3544600

CHEMBL3544600
0.1170.1580.518DNA methylase inhibitor

0.151 0.117 CHEMBL1190855

0.518 0.005 CHEMBL3544704

0.146 0.12 CHEMBL3544622

0.255 0.045 CHEMBL3559662

0.243 0.052 CHEMBL3544790

0.153 0.114 CHEMBL3544598

0.211 0.072 CHEMBL3544625

0.174 0.098 CHEMBL3544626

0.168 0.102 CHEMBL1741437

CHEMBL3544704
0.0370.080.082Alpha-mannosidase inhibitor

0.056 0.033 CHEMBL6200

0.056 0.032 CHEMBL3544720

0.051 0.041 CHEMBL3544599

0.055 0.035 CHEMBL1614639

0.082 0.01 CHEMBL3544598

0.052 0.039 CHEMBL3544623

0.054 0.036 CHEMBL1741437

CHEMBL3544598
0.080.1230.272Beta amyloid protein antagonist

0.133 0.054 CHEMBL6200

0.129 0.058 CHEMBL3544623

0.272 0.007 CHEMBL3544624

0.148 0.042 CHEMBL3544626

0.148 0.042 CHEMBL1741437

CHEMBL3544624
0.0140.0580.019Thymidine kinase (Herpes simplex virus 2) inhibitor

0.019 0.018 CHEMBL3544719

CHEMBL3544719
0.0640.1080.134Protein kinase (CK2) inhibitor

0.105 0.06 CHEMBL6200

0.103 0.061 CHEMBL3544719

0.134 0.04 CHEMBL3544621

0.084 0.079 CHEMBL3544626

0.134 0.04 CHEMBL1741437

CHEMBL1741437
0.0070.0510.026Integrin alphaVbeta6 antagonist

0.013 0.012 CHEMBL3544623

0.026 0.004 CHEMBL3544626

0.024 0.004 CHEMBL1741437

CHEMBL3544626
0.0130.0580.022Protease (Human cytomegalovirus) inhibitor

0.022 0.015 CHEMBL3544600

CHEMBL3544600
0.0880.1340.126Sodium channel blocker

0.126 0.078 CHEMBL6200

CHEMBL6200
0.0630.110.39Bronchodilator

0.287 0.01 CHEMBL3544718

0.089 0.076 CHEMBL578211

0.37 0.006 CHEMBL3544793

0.094 0.071 CHEMBL1614639

0.39 0.005 CHEMBL3544623

0.235 0.014 CHEMBL3544624

0.125 0.042 CHEMBL3544626

0.108 0.054 CHEMBL1741437

CHEMBL3544623
0.0210.0680.196Histone deacetylase 7 inhibitor

0.034 0.029 CHEMBL3544719

0.148 0.005 CHEMBL3544721

0.095 0.009 CHEMBL3544622

0.057 0.016 CHEMBL3544790

0.196 0.004 CHEMBL3544600

0.067 0.014 CHEMBL3544625

0.047 0.019 CHEMBL3544626

CHEMBL3544600
0.0180.0650.033Calcitonin receptor agonist

0.033 0.024 CHEMBL3544623

0.032 0.025 CHEMBL3544626

CHEMBL3544623
0.0990.1470.159Ca2+/calmodulin-dependent kinase II gamma inhibitor

0.159 0.083 CHEMBL3544622

0.129 0.107 CHEMBL3544791

CHEMBL3544622
0.0270.0750.037Potassium channel Kv1.1 blocker

0.037 0.028 CHEMBL3544721

0.035 0.032 CHEMBL1741437

CHEMBL3544721
0.1110.160.284Interferon gamma antagonist

0.128 0.115 CHEMBL6200

0.13 0.111 CHEMBL3544719

0.125 0.122 CHEMBL3544721

0.186 0.047 CHEMBL3544622

0.284 0.022 CHEMBL3544790

0.174 0.054 CHEMBL3544600

0.179 0.051 CHEMBL3544598

0.266 0.025 CHEMBL3544623

0.243 0.03 CHEMBL3544624

0.234 0.031 CHEMBL3544625

0.276 0.024 CHEMBL3544626

0.231 0.032 CHEMBL1741437

CHEMBL3544790
0.0670.1170.16Cyclin-dependent kinase 5 inhibitor

0.14 0.046 CHEMBL6200

0.16 0.035 CHEMBL3544719

CHEMBL3544719
0.0770.1270.107Hedgehog signaling inhibitor

0.107 0.054 CHEMBL3544624

CHEMBL3544624
0.0760.1260.203Alkylator

0.106 0.082 CHEMBL1190855

0.203 0.025 CHEMBL3544704

0.132 0.058 CHEMBL3544721

0.114 0.074 CHEMBL3544791

0.147 0.048 CHEMBL3559662

0.133 0.057 CHEMBL3544790

0.097 0.092 CHEMBL3544600

0.182 0.032 CHEMBL3544598

0.115 0.073 CHEMBL3544624

0.12 0.068 CHEMBL3544626

CHEMBL3544704
0.0840.1350.47Phosphodiesterase inhibitor

0.117 0.085 CHEMBL3544718

0.47 0.005 CHEMBL3544793

CHEMBL3544793
0.0120.0630.042Poly(ADP-ribose) polymerase 2 inhibitor

0.042 0.011 CHEMBL6200

CHEMBL6200
0.0190.070.056Diamine oxidase inhibitor

0.056 0.011 CHEMBL3544721

0.041 0.022 CHEMBL3544622

0.034 0.031 CHEMBL3544625

0.04 0.023 CHEMBL1741437

CHEMBL3544721
0.0490.1030.101Histone deacetylase SIRT3 inhibitor

0.062 0.043 CHEMBL6200

0.068 0.031 CHEMBL3544719

0.101 0.01 CHEMBL3544721

0.098 0.01 CHEMBL3544622

0.081 0.017 CHEMBL3544600

0.063 0.04 CHEMBL3544626

0.058 0.054 CHEMBL1741437

CHEMBL3544721
0.0090.0630.022Hexokinase stimulant

0.022 0.013 CHEMBL1741437

CHEMBL1741437
0.0320.0860.088Beta 1 adrenoreceptor antagonist

0.077 0.02 CHEMBL3544721

0.088 0.014 CHEMBL3544623

0.08 0.018 CHEMBL3544626

0.077 0.02 CHEMBL1741437

CHEMBL3544623
0.1190.1730.185ATPase inhibitor

0.185 0.052 CHEMBL3544598

0.171 0.069 CHEMBL3544624

0.174 0.066 CHEMBL1741437

CHEMBL3544598
0.0380.0940.092NMDA 2 receptor antagonist

0.077 0.046 CHEMBL1190855

0.092 0.037 CHEMBL6200

CHEMBL6200
0.0830.1390.165Cytokine production inhibitor

0.151 0.062 CHEMBL3544719

0.145 0.066 CHEMBL578211

0.118 0.091 CHEMBL3544622

0.13 0.079 CHEMBL3544625

0.165 0.051 CHEMBL3544626

0.139 0.072 CHEMBL1741437

CHEMBL3544626
0.0380.0940.512Thromboxane synthase inhibitor

0.053 0.042 CHEMBL3544719

0.091 0.008 CHEMBL3544721

0.074 0.015 CHEMBL3544622

0.234 0.003 CHEMBL3544790

0.07 0.018 CHEMBL3544600

0.233 0.003 CHEMBL3544623

0.077 0.013 CHEMBL3544624

0.486 0.002 CHEMBL3544625

0.512 0.002 CHEMBL3544626

0.277 0.003 CHEMBL1741437

CHEMBL3544626
0.0350.0910.073NMDA 2C receptor antagonist

0.073 0.031 CHEMBL6200

0.055 0.053 CHEMBL3544623

0.064 0.04 CHEMBL3544626

0.066 0.038 CHEMBL1741437

CHEMBL6200
0.0610.1170.13Pim-1 kinase inhibitor

0.13 0.036 CHEMBL6200

CHEMBL6200
0.0410.0980.356Phenylalanine 4-hydroxylase inhibitor

0.069 0.047 CHEMBL6200

0.069 0.047 CHEMBL3544719

0.09 0.031 CHEMBL3544721

0.091 0.03 CHEMBL3544622

0.226 0.005 CHEMBL3544790

0.356 0.003 CHEMBL3544623

0.075 0.041 CHEMBL3544624

0.23 0.005 CHEMBL3544625

0.325 0.004 CHEMBL3544626

0.296 0.004 CHEMBL1741437

CHEMBL3544623
0.0080.0660.022Adenosine kinase inhibitor

0.022 0.015 CHEMBL3544704

CHEMBL3544704
0.0770.1340.122MAP kinase 12 inhibitor

0.122 0.068 CHEMBL6200

0.108 0.087 CHEMBL3544719

CHEMBL6200
0.0250.0830.09Histamine H2 receptor agonist

0.09 0.005 CHEMBL3544721

0.064 0.013 CHEMBL3544622

0.079 0.008 CHEMBL3544600

0.043 0.029 CHEMBL3544626

CHEMBL3544721
0.0670.1250.116Granulocyte macrophage colony stimulating factor agonist

0.088 0.056 CHEMBL6200

0.092 0.047 CHEMBL3544719

0.079 0.078 CHEMBL3544721

0.095 0.042 CHEMBL3544622

0.112 0.022 CHEMBL3544790

0.084 0.065 CHEMBL3544623

0.105 0.028 CHEMBL3544624

0.091 0.05 CHEMBL3544625

0.097 0.039 CHEMBL3544626

0.116 0.019 CHEMBL1741437

CHEMBL1741437
0.0060.0650.0945-Alpha-reductase 1 inhibitor

0.022 0.01 CHEMBL578211

0.094 0.005 CHEMBL3544791

CHEMBL3544791
0.0290.0880.086Glutamate (mGluR1) antagonist

0.057 0.042 CHEMBL3544719

0.086 0.021 CHEMBL1741437

CHEMBL1741437
0.0280.0870.058Vanilloid 3 antagonist

0.046 0.012 CHEMBL3544790

0.041 0.019 CHEMBL3544623

0.041 0.02 CHEMBL3544624

0.043 0.016 CHEMBL3544625

0.058 0.005 CHEMBL3544626

0.054 0.006 CHEMBL1741437

CHEMBL3544626
0.0210.0810.052Carboxypeptidase B inhibitor

0.035 0.02 CHEMBL3544790

0.034 0.021 CHEMBL3544623

0.033 0.023 CHEMBL3544625

0.052 0.006 CHEMBL3544626

0.043 0.01 CHEMBL1741437

CHEMBL3544626
0.0210.0820.153Glutamate (mGluR3) antagonist

0.034 0.03 CHEMBL3544622

0.056 0.01 CHEMBL3544790

0.047 0.014 CHEMBL3544623

0.042 0.019 CHEMBL3544625

0.153 0.004 CHEMBL3544626

0.076 0.005 CHEMBL1741437

CHEMBL3544626
0.020.0810.194Factor XIIIa inhibitor

0.163 0.004 CHEMBL3544721

0.194 0.003 CHEMBL3544622

0.112 0.005 CHEMBL3544790

0.16 0.004 CHEMBL3544600

0.039 0.024 CHEMBL3544625

0.041 0.022 CHEMBL3544626

CHEMBL3544622
0.1070.1680.179Sphingosine 1-phosphate receptor 5 antagonist

0.163 0.042 CHEMBL6200

0.131 0.099 CHEMBL3544790

0.175 0.028 CHEMBL3544626

0.179 0.024 CHEMBL1741437

CHEMBL1741437
0.1110.1720.141Ca2+/calmodulin-dependent protein kinase kinase B inhibitor

0.127 0.123 CHEMBL3544720

0.141 0.091 CHEMBL3544719

0.139 0.095 CHEMBL3544599

0.127 0.123 CHEMBL1741437

CHEMBL3544719
0.1180.180.154Death-associated protein kinase 3 inhibitor

0.154 0.116 CHEMBL6200

CHEMBL6200
0.0170.0790.039Epoxide hydrolase 1 inhibitor

0.039 0.012 CHEMBL3544626

0.032 0.02 CHEMBL1741437

CHEMBL3544626
0.0150.0770.04Glutamate (mGluR1) agonist

0.025 0.015 CHEMBL3544790

0.024 0.018 CHEMBL3544625

0.032 0.008 CHEMBL3544626

0.04 0.005 CHEMBL1741437

CHEMBL1741437
0.0180.080.043NMDA receptor subunit 3A antagonist

0.043 0.024 CHEMBL1741437

CHEMBL1741437
0.1290.1910.202Histone acetyltransferase inhibitor

0.202 0.066 CHEMBL3544719

0.193 0.079 CHEMBL578211

0.165 0.119 CHEMBL3544721

0.196 0.075 CHEMBL3544622

0.16 0.126 CHEMBL3544790

0.191 0.083 CHEMBL3544600

CHEMBL3544719
0.0040.0670.012Integrin beta2 antagonist

0.012 0.01 CHEMBL3544625

CHEMBL3544625
0.0150.080.089G protein-coupled receptor agonist

0.039 0.026 CHEMBL3544790

0.089 0.007 CHEMBL3544626

0.047 0.02 CHEMBL1741437

CHEMBL3544626
0.080.1450.133Ca2+/calmodulin-dependent kinase II delta inhibitor

0.129 0.078 CHEMBL1190855

0.122 0.082 CHEMBL3544721

0.133 0.075 CHEMBL3544791

CHEMBL3544791
0.0260.0910.048Thymidine kinase inhibitor

0.048 0.02 CHEMBL3544704

0.045 0.023 CHEMBL3559662

0.041 0.028 CHEMBL1614639

0.043 0.025 CHEMBL3544626

0.038 0.034 CHEMBL1741437

CHEMBL3544704
0.0320.0980.076Myc inhibitor

0.076 0.015 CHEMBL6200

0.062 0.027 CHEMBL3544721

CHEMBL6200
0.0140.080.031LFA antagonist

0.031 0.014 CHEMBL3544625

0.029 0.017 CHEMBL3544626

CHEMBL3544625
0.0030.0690.015Carboxypeptidase B2 inhibitor

0.015 0.005 CHEMBL3544626

0.01 0.009 CHEMBL1741437

CHEMBL3544626
0.0290.0960.486Alcohol oxidase inhibitor

0.059 0.036 CHEMBL3544719

0.162 0.009 CHEMBL3544622

0.049 0.047 CHEMBL3544599

0.063 0.033 CHEMBL1614639

0.251 0.005 CHEMBL3544790

0.215 0.006 CHEMBL3544623

0.08 0.024 CHEMBL3544624

0.199 0.006 CHEMBL3544625

0.251 0.005 CHEMBL3544626

0.486 0.004 CHEMBL1741437

CHEMBL1741437
0.0520.1190.081S-adenosyl-L-methionine decarboxylase inhibitor

0.074 0.049 CHEMBL6200

0.08 0.037 CHEMBL3544721

0.077 0.042 CHEMBL3544622

0.07 0.061 CHEMBL3544625

0.069 0.063 CHEMBL3544626

0.081 0.035 CHEMBL1741437

CHEMBL1741437
0.020.0870.046Poly(ADP-ribose) polymerase 1 inhibitor

0.046 0.019 CHEMBL6200

CHEMBL6200
0.0150.0820.027Somatostatin agonist

0.027 0.026 CHEMBL6200

CHEMBL6200
0.0770.1450.156Ribosomal protein S6 kinase inhibitor

0.156 0.06 CHEMBL6200

CHEMBL6200
0.0090.0770.043Glycine transporter 1 inhibitor

0.043 0.019 CHEMBL6200

CHEMBL6200
0.0060.0750.185Prostaglandin H2 antagonist

0.056 0.003 CHEMBL3544790

0.056 0.003 CHEMBL3544623

0.037 0.008 CHEMBL3544624

0.144 0.002 CHEMBL3544625

0.185 0.001 CHEMBL3544626

0.103 0.002 CHEMBL1741437

CHEMBL3544626
0.0160.0840.038Purinergic P2X7 antagonist

0.038 0.023 CHEMBL578211

CHEMBL578211
0.050.1190.188Adrenaline agonist

0.076 0.063 CHEMBL6200

0.114 0.028 CHEMBL3544721

0.188 0.008 CHEMBL3544623

0.099 0.038 CHEMBL3544626

0.103 0.035 CHEMBL1741437

CHEMBL3544623
0.0390.1090.39Histidine decarboxylase inhibitor

0.072 0.049 CHEMBL3544622

0.117 0.026 CHEMBL3544790

0.098 0.033 CHEMBL3544623

0.12 0.025 CHEMBL3544624

0.134 0.022 CHEMBL3544625

0.157 0.018 CHEMBL3544626

0.39 0.004 CHEMBL1741437

CHEMBL1741437
0.0140.0840.096Nicotinic acid receptor agonist

0.096 0.005 CHEMBL3544626

0.084 0.006 CHEMBL1741437

CHEMBL3544626
0.0620.1320.109Protein-tyrosine kinase (PTK, not ETK, WZC) inhibitor

0.109 0.079 CHEMBL3544718

CHEMBL3544718
0.040.110.109DNA gyrase inhibitor

0.093 0.02 CHEMBL6200

0.084 0.024 CHEMBL3544719

0.109 0.015 CHEMBL3544623

CHEMBL3544623
0.0260.0970.06Poly(ADP-ribose) polymerase inhibitor

0.06 0.017 CHEMBL6200

CHEMBL6200
0.0610.1320.108Abl kinase inhibitor

0.108 0.079 CHEMBL3544718

CHEMBL3544718
0.0050.0760.0161-Deoxy-D-xylulose-5-phosphate reductoisomerase inhibitor

0.013 0.009 CHEMBL3544622

0.014 0.007 CHEMBL3544600

0.016 0.005 CHEMBL3544626

0.014 0.008 CHEMBL1741437

CHEMBL3544626
0.0240.0950.206Aromatase inhibitor

0.059 0.042 CHEMBL6200

0.077 0.029 CHEMBL3544719

0.206 0.008 CHEMBL3544624

0.055 0.045 CHEMBL3544625

0.076 0.03 CHEMBL3544626

0.089 0.024 CHEMBL1741437

CHEMBL3544624
0.0850.1560.509Peroxidase inhibitor

0.154 0.076 CHEMBL6200

0.185 0.063 CHEMBL3544719

0.113 0.108 CHEMBL3544721

0.358 0.027 CHEMBL3544622

0.114 0.106 CHEMBL3544599

0.415 0.018 CHEMBL3544790

0.196 0.06 CHEMBL3544600

0.509 0.009 CHEMBL3544623

0.261 0.045 CHEMBL3544624

0.356 0.027 CHEMBL3544625

0.483 0.011 CHEMBL3544626

0.508 0.009 CHEMBL1741437

CHEMBL3544623
0.0210.0920.043GABA uptake inhibitor

0.039 0.028 CHEMBL3544790

0.038 0.029 CHEMBL3544625

0.043 0.022 CHEMBL3544626

CHEMBL3544626
0.0230.0950.074Mannosidase inhibitor

0.042 0.036 CHEMBL6200

0.041 0.038 CHEMBL3544720

0.041 0.039 CHEMBL1614639

0.074 0.01 CHEMBL3544598

0.064 0.014 CHEMBL3544623

0.05 0.025 CHEMBL3544626

0.043 0.035 CHEMBL1741437

CHEMBL3544598
0.0090.0820.057Arginase inhibitor

0.037 0.025 CHEMBL3544704

0.033 0.029 CHEMBL3544790

0.057 0.012 CHEMBL3544626

0.039 0.023 CHEMBL1741437

CHEMBL3544626
0.1130.1860.2613C-like protease (Human coronavirus) inhibitor

0.172 0.072 CHEMBL6200

0.148 0.105 CHEMBL3544719

0.261 0.023 CHEMBL3544622

0.148 0.105 CHEMBL3544790

0.147 0.107 CHEMBL3544600

0.137 0.126 CHEMBL3544624

0.151 0.099 CHEMBL3544625

0.134 0.132 CHEMBL3544626

0.178 0.066 CHEMBL1741437

CHEMBL3544622
0.0110.0850.027Glutaminyl-peptide cyclotransferase inhibitor

0.027 0.008 CHEMBL3544721

CHEMBL3544721
0.0390.1140.056Cathepsin E inhibitor

0.056 0.048 CHEMBL3544622

CHEMBL3544622
0.080.1560.151Cathepsin H inhibitor

0.11 0.09 CHEMBL3544721

0.151 0.046 CHEMBL3544622

0.113 0.085 CHEMBL3544790

0.15 0.046 CHEMBL3544625

0.139 0.055 CHEMBL3544626

0.134 0.06 CHEMBL1741437

CHEMBL3544622
0.0330.1090.143Carbonic anhydrase stimulant

0.07 0.031 CHEMBL6200

0.087 0.023 CHEMBL3544721

0.077 0.027 CHEMBL3544622

0.069 0.032 CHEMBL3544790

0.067 0.034 CHEMBL3544600

0.096 0.02 CHEMBL3544623

0.064 0.036 CHEMBL3544625

0.143 0.012 CHEMBL3544626

0.117 0.015 CHEMBL1741437

CHEMBL3544626
0.0150.0910.029Integrin alpha2beta1 antagonist

0.029 0.014 CHEMBL1741437

CHEMBL1741437
0.0380.1140.066Sphingosine kinase inhibitor

0.055 0.049 CHEMBL6200

0.066 0.029 CHEMBL3544626

CHEMBL3544626
0.0620.1390.394Ferrochelatase inhibitor

0.098 0.073 CHEMBL3544719

0.09 0.083 CHEMBL578211

0.187 0.025 CHEMBL3544622

0.089 0.084 CHEMBL3544791

0.088 0.085 CHEMBL3544599

0.27 0.01 CHEMBL3544790

0.374 0.004 CHEMBL3544623

0.313 0.006 CHEMBL3544625

0.394 0.004 CHEMBL3544626

0.337 0.005 CHEMBL1741437

CHEMBL3544626
0.0280.1060.071DNA gyrase subunit A inhibitor

0.064 0.009 CHEMBL6200

0.071 0.007 CHEMBL3544719

CHEMBL3544719
0.0750.1530.211Acetylcholinesterase inhibitor

0.173 0.043 CHEMBL3544718

0.211 0.03 CHEMBL1190855

0.169 0.045 CHEMBL3544721

0.108 0.093 CHEMBL3544791

CHEMBL1190855
0.0060.0840.033Thromboxane A2 agonist

0.018 0.008 CHEMBL3544790

0.018 0.007 CHEMBL3544623

0.019 0.006 CHEMBL3544625

0.033 0.003 CHEMBL3544626

0.017 0.009 CHEMBL1741437

CHEMBL3544626
0.0140.0920.043ICAM 1 antagonist

0.024 0.014 CHEMBL3544622

0.023 0.015 CHEMBL3544600

0.043 0.004 CHEMBL3544625

0.027 0.009 CHEMBL3544626

0.04 0.004 CHEMBL1741437

CHEMBL3544625
0.1350.2140.169MAP-kinase-activated kinase 5 inhibitor

0.169 0.15 CHEMBL6200

0.165 0.156 CHEMBL578211

0.169 0.15 CHEMBL3544599

CHEMBL3544599
0.040.120.252Glutamate decarboxylase inhibitor

0.123 0.02 CHEMBL3544622

0.242 0.005 CHEMBL3544790

0.252 0.004 CHEMBL3544623

0.166 0.01 CHEMBL3544625

0.222 0.005 CHEMBL3544626

0.249 0.004 CHEMBL1741437

CHEMBL3544623
0.0040.0840.015Integrin alpha4beta1 antagonist

0.015 0.011 CHEMBL3544626

0.015 0.011 CHEMBL1741437

CHEMBL1741437
0.0320.1120.05Squalene epoxidase inhibitor

0.05 0.035 CHEMBL3544721

0.05 0.034 CHEMBL3544625

CHEMBL3544625
0.0090.0920.0465-Alpha-reductase 2 inhibitor

0.017 0.016 CHEMBL578211

0.046 0.007 CHEMBL3544791

CHEMBL3544791
0.0380.1220.264Amidase inhibitor

0.174 0.007 CHEMBL3544721

0.12 0.016 CHEMBL3544622

0.115 0.017 CHEMBL3544790

0.264 0.004 CHEMBL3544600

0.133 0.012 CHEMBL3544626

0.111 0.019 CHEMBL1741437

CHEMBL3544600
0.0390.1220.078I kappa B kinase 2 inhibitor

0.078 0.024 CHEMBL6200

CHEMBL6200
0.0210.1050.092Tubulin agonist

0.092 0.003 CHEMBL3544624

CHEMBL3544624
0.010.0940.021Antibiotic Anthracycline-like

0.021 0.009 CHEMBL3544598

CHEMBL3544598
0.0110.0970.089Kainate receptor 2 antagonist

0.089 0.005 CHEMBL3544625

0.076 0.007 CHEMBL3544626

0.072 0.008 CHEMBL1741437

CHEMBL3544625
0.0150.1010.029Purinergic P2Y15 antagonist

0.028 0.02 CHEMBL3544721

0.027 0.024 CHEMBL3544622

0.029 0.019 CHEMBL3544600

CHEMBL3544600
0.0480.1330.144Exportin-1 inhibitor

0.102 0.008 CHEMBL3544622

0.076 0.031 CHEMBL3544790

0.085 0.019 CHEMBL3544623

0.144 0.004 CHEMBL3544624

0.091 0.014 CHEMBL3544625

0.09 0.015 CHEMBL3544626

0.104 0.008 CHEMBL1741437

CHEMBL3544624
0.0220.1080.071AMPA 4 receptor antagonist

0.047 0.018 CHEMBL3544626

0.071 0.008 CHEMBL1741437

CHEMBL1741437
0.1650.2520.25115-Lipoxygenase inhibitor

0.214 0.198 CHEMBL3544625

0.251 0.164 CHEMBL3544626

CHEMBL3544626
0.0130.10.034Glutamate (mGluR2) antagonist

0.034 0.015 CHEMBL3544626

0.033 0.016 CHEMBL1741437

CHEMBL3544626
0.0470.1350.089NMDA receptor antagonist

0.089 0.055 CHEMBL6200

0.081 0.064 CHEMBL1741437

CHEMBL6200
0.0450.1340.073Kallikrein 7 inhibitor

0.065 0.04 CHEMBL3544719

0.067 0.035 CHEMBL3544721

0.073 0.022 CHEMBL3544622

0.068 0.032 CHEMBL3544600

CHEMBL3544622
0.0120.1010.1075-Alpha-reductase inhibitor

0.049 0.019 CHEMBL578211

0.107 0.009 CHEMBL3544791

0.033 0.03 CHEMBL1614639

0.037 0.026 CHEMBL3544790

CHEMBL3544791
0.0230.1120.038Neurokinin 2 agonist

0.038 0.034 CHEMBL3544622

CHEMBL3544622
0.1180.2080.146Cyclin-dependent kinase 3 inhibitor

0.146 0.106 CHEMBL3544720

0.145 0.11 CHEMBL3544599

CHEMBL3544720
0.030.1210.065Androgen agonist

0.065 0.035 CHEMBL1614639

CHEMBL1614639
0.0080.10.018CC chemokine 9 receptor antagonist

0.018 0.009 CHEMBL1741437

CHEMBL1741437
0.0530.1440.117Chemokine receptor antagonist

0.117 0.049 CHEMBL3544793

CHEMBL3544793
0.0160.1080.041Melanocortin 1 antagonist

0.041 0.024 CHEMBL3544622

CHEMBL3544622
0.0270.1190.074Farnesyltransferase inhibitor

0.074 0.014 CHEMBL3544793

0.043 0.037 CHEMBL3544626

CHEMBL3544793
0.0150.1070.034Thrombin receptor antagonist

0.033 0.015 CHEMBL3544721

0.034 0.014 CHEMBL3544622

CHEMBL3544622
0.0260.1180.083Kainate receptor agonist

0.041 0.03 CHEMBL3544791

0.048 0.016 CHEMBL3544790

0.045 0.021 CHEMBL3544623

0.083 0.004 CHEMBL3544625

0.055 0.01 CHEMBL3544626

0.072 0.004 CHEMBL1741437

CHEMBL3544625
0.0170.1090.081Toll-Like receptor 2 agonist

0.047 0.025 CHEMBL3544622

0.048 0.025 CHEMBL3544790

0.063 0.019 CHEMBL3544623

0.04 0.029 CHEMBL3544625

0.081 0.016 CHEMBL3544626

0.056 0.021 CHEMBL1741437

CHEMBL3544626
0.0090.1020.052Histone deacetylase 10 inhibitor

0.041 0.015 CHEMBL3544721

0.044 0.014 CHEMBL3544622

0.052 0.011 CHEMBL3544600

CHEMBL3544600
0.1090.2020.263Antiamyloidogenic

0.263 0.065 CHEMBL3544721

0.215 0.089 CHEMBL3544622

0.2 0.1 CHEMBL3544790

0.2 0.099 CHEMBL3544600

0.185 0.11 CHEMBL3544623

0.221 0.086 CHEMBL3544624

0.217 0.088 CHEMBL3544625

0.186 0.109 CHEMBL3544626

0.177 0.117 CHEMBL1741437

CHEMBL3544721
0.0120.1060.024Toll-Like receptor 8 agonist

0.024 0.008 CHEMBL3544626

CHEMBL3544626
0.0280.1220.166Carbamoyl phosphate synthetase inhibitor

0.086 0.026 CHEMBL3544704

0.056 0.047 CHEMBL3544622

0.067 0.037 CHEMBL3559662

0.161 0.01 CHEMBL3544790

0.159 0.01 CHEMBL3544623

0.122 0.015 CHEMBL3544625

0.166 0.01 CHEMBL3544626

0.128 0.014 CHEMBL1741437

CHEMBL3544626
0.0740.170.143NADPH oxidase inhibitor

0.109 0.099 CHEMBL3544626

0.143 0.059 CHEMBL1741437

CHEMBL1741437
0.0170.1130.124AMPA receptor antagonist

0.062 0.024 CHEMBL3544626

0.124 0.008 CHEMBL1741437

CHEMBL1741437
0.0560.1520.285Triose-phosphate isomerase inhibitor

0.094 0.054 CHEMBL3544622

0.223 0.009 CHEMBL3544790

0.093 0.055 CHEMBL3544598

0.243 0.007 CHEMBL3544623

0.159 0.018 CHEMBL3544625

0.285 0.005 CHEMBL3544626

0.189 0.012 CHEMBL1741437

CHEMBL3544626
0.040.1360.149Histone deacetylase SIRT1 stimulant

0.149 0.009 CHEMBL3544704

0.134 0.013 CHEMBL3559662

0.071 0.054 CHEMBL3544598

0.097 0.03 CHEMBL3544625

CHEMBL3544704
0.040.1360.149Histone deacetylase stimulant

0.149 0.009 CHEMBL3544704

0.134 0.013 CHEMBL3559662

0.071 0.054 CHEMBL3544598

0.097 0.03 CHEMBL3544625

CHEMBL3544704
0.0120.1080.098Free fatty acid receptor 1 antagonist

0.058 0.006 CHEMBL3544790

0.046 0.011 CHEMBL3544623

0.049 0.009 CHEMBL3544625

0.098 0.003 CHEMBL3544626

0.081 0.004 CHEMBL1741437

CHEMBL3544626
0.1450.2430.462Immunomodulator

0.216 0.146 CHEMBL6200

0.462 0.029 CHEMBL3544704

0.314 0.075 CHEMBL3544719

0.209 0.153 CHEMBL578211

0.236 0.127 CHEMBL3544791

0.311 0.076 CHEMBL3559662

0.194 0.172 CHEMBL3544793

0.445 0.032 CHEMBL3544621

0.201 0.163 CHEMBL3544790

0.38 0.05 CHEMBL3544598

0.349 0.06 CHEMBL3544624

0.28 0.094 CHEMBL3544625

0.276 0.096 CHEMBL3544626

0.303 0.08 CHEMBL1741437

CHEMBL3544704
0.0540.1520.232Expectorant

0.232 0.015 CHEMBL3544704

0.105 0.063 CHEMBL3544790

0.202 0.02 CHEMBL3544598

0.124 0.048 CHEMBL3544623

0.096 0.073 CHEMBL3544625

0.105 0.063 CHEMBL3544626

0.129 0.045 CHEMBL1741437

CHEMBL3544704
0.0410.1390.143MAP-kinase-activated kinase 2 inhibitor

0.143 0.013 CHEMBL6200

0.097 0.03 CHEMBL3544719

CHEMBL6200
0.0470.1470.196Aminopeptidase B inhibitor

0.1 0.065 CHEMBL3544721

0.118 0.054 CHEMBL3544622

0.164 0.032 CHEMBL3544790

0.082 0.08 CHEMBL3544600

0.154 0.036 CHEMBL3544623

0.155 0.036 CHEMBL3544625

0.196 0.022 CHEMBL3544626

0.192 0.023 CHEMBL1741437

CHEMBL3544626
0.0160.1180.066Glutamate (mGluR group II) antagonist

0.044 0.021 CHEMBL3544790

0.066 0.009 CHEMBL3544626

0.056 0.013 CHEMBL1741437

CHEMBL3544626
0.0440.1460.1I kappa B kinase inhibitor

0.1 0.039 CHEMBL6200

CHEMBL6200
0.030.1330.06Bombesin 2 receptor antagonist

0.049 0.034 CHEMBL3544622

0.053 0.03 CHEMBL3544626

0.06 0.024 CHEMBL1741437

CHEMBL1741437
0.0170.120.051Integrin alpha5beta1 antagonist

0.05 0.018 CHEMBL3544626

0.051 0.017 CHEMBL1741437

CHEMBL1741437
0.0120.1150.108Vasopressin 2 antagonist

0.108 0.005 CHEMBL3126023

CHEMBL3126023
0.0280.1310.061NMDA 2B receptor antagonist

0.061 0.03 CHEMBL1190855

CHEMBL1190855
0.0590.1630.328Cholesterol synthesis inhibitor

0.232 0.02 CHEMBL3544790

0.304 0.011 CHEMBL3544623

0.219 0.023 CHEMBL3544624

0.238 0.019 CHEMBL3544625

0.328 0.009 CHEMBL3544626

0.318 0.01 CHEMBL1741437

CHEMBL3544626
0.0420.1470.115Somatostatin 1 agonist

0.115 0.026 CHEMBL3544719

0.07 0.065 CHEMBL3544623

CHEMBL3544719
0.0940.20.195Adenylate cyclase stimulant

0.137 0.086 CHEMBL6200

0.167 0.039 CHEMBL3544721

0.125 0.112 CHEMBL3544622

0.171 0.034 CHEMBL3544790

0.134 0.092 CHEMBL3544600

0.195 0.016 CHEMBL3544623

0.185 0.022 CHEMBL3544625

0.195 0.016 CHEMBL3544626

0.169 0.037 CHEMBL1741437

CHEMBL3544626
0.0050.1110.01Purinergic P2Y2 agonist

0.01 0.008 CHEMBL3544704

CHEMBL3544704
0.0460.1530.153MAP-kinase-activated kinase inhibitor

0.153 0.014 CHEMBL6200

0.108 0.033 CHEMBL3544719

CHEMBL6200
0.0060.1130.025Inosine monophosphate dehydrogenase 2 inhibitor

0.019 0.015 CHEMBL3544790

0.025 0.01 CHEMBL3544625

0.019 0.014 CHEMBL3544626

CHEMBL3544625
0.0190.1270.04Integrin alpha2 antagonist

0.04 0.021 CHEMBL1741437

CHEMBL1741437
0.0730.1820.156Protein kinase C nu inhibitor

0.135 0.079 CHEMBL3544720

0.156 0.066 CHEMBL3544599

CHEMBL3544599
0.0260.1350.052VCAM-1 antagonist

0.044 0.015 CHEMBL3544790

0.04 0.025 CHEMBL3544623

0.047 0.012 CHEMBL3544625

0.052 0.008 CHEMBL3544626

0.046 0.013 CHEMBL1741437

CHEMBL3544626
0.0150.1250.115Ribonucleoside-diphosphate reductase inhibitor

0.059 0.035 CHEMBL3544622

0.06 0.034 CHEMBL3544790

0.051 0.04 CHEMBL3544600

0.055 0.037 CHEMBL3544623

0.051 0.04 CHEMBL3544625

0.115 0.017 CHEMBL3544626

0.067 0.03 CHEMBL1741437

CHEMBL3544626
0.0610.1710.092Estrogen-related receptor beta agonist

0.087 0.046 CHEMBL3544790

0.079 0.071 CHEMBL3544623

0.092 0.037 CHEMBL3544626

0.091 0.039 CHEMBL1741437

CHEMBL3544626
0.0260.1350.052VCAM antagonist

0.044 0.015 CHEMBL3544790

0.04 0.026 CHEMBL3544623

0.047 0.012 CHEMBL3544625

0.052 0.008 CHEMBL3544626

0.046 0.013 CHEMBL1741437

CHEMBL3544626
0.0580.1690.083Potassium channel (Voltage-sensitive) activator

0.083 0.082 CHEMBL3544600

CHEMBL3544600
0.0190.1320.05NMDA receptor subunit 3B antagonist

0.039 0.036 CHEMBL3544626

0.05 0.025 CHEMBL1741437

CHEMBL1741437
0.0770.190.187Protein kinase stimulant

0.128 0.085 CHEMBL3544704

0.146 0.071 CHEMBL3544790

0.178 0.051 CHEMBL3544623

0.187 0.047 CHEMBL3544624

0.154 0.066 CHEMBL3544625

0.173 0.054 CHEMBL3544626

CHEMBL3544624
0.0160.130.121Oleamide hydrolase inhibitor

0.116 0.007 CHEMBL3544721

0.058 0.021 CHEMBL3544622

0.071 0.015 CHEMBL3544790

0.121 0.006 CHEMBL3544600

0.074 0.014 CHEMBL3544623

0.121 0.006 CHEMBL3544626

0.064 0.018 CHEMBL1741437

CHEMBL3544626
0.0310.1440.155Phosphodiesterase 4B inhibitor

0.061 0.055 CHEMBL3544719

0.066 0.048 CHEMBL578211

0.155 0.012 CHEMBL3544793

0.107 0.022 CHEMBL1741437

CHEMBL3544793
0.0080.1220.059AMPA 3 receptor antagonist

0.042 0.013 CHEMBL3544626

0.059 0.006 CHEMBL1741437

CHEMBL1741437
0.0140.1280.111Ribonucleotide reductase inhibitor

0.059 0.037 CHEMBL3544622

0.061 0.036 CHEMBL3544790

0.051 0.042 CHEMBL3544600

0.055 0.039 CHEMBL3544623

0.05 0.042 CHEMBL3544625

0.111 0.018 CHEMBL3544626

0.068 0.032 CHEMBL1741437

CHEMBL3544626
0.0530.1670.109Factor XII inhibitor

0.109 0.03 CHEMBL3544719

0.105 0.034 CHEMBL3544622

CHEMBL3544719
0.0120.1270.181Histone deacetylase class I inhibitor

0.106 0.007 CHEMBL3544721

0.078 0.011 CHEMBL3544622

0.181 0.005 CHEMBL3544600

CHEMBL3544600
0.010.1250.076Protocollagen prolyl hydroxylase inhibitor

0.037 0.009 CHEMBL3544790

0.025 0.023 CHEMBL3544625

0.043 0.007 CHEMBL3544626

0.076 0.005 CHEMBL1741437

CHEMBL1741437
0.0230.1380.224Phosphodiesterase 4C inhibitor

0.224 0.005 CHEMBL3544793

CHEMBL3544793
0.020.1350.048Purinergic P2X antagonist

0.048 0.034 CHEMBL578211

CHEMBL578211
0.1220.2380.325Glyceraldehyde-3-phosphate dehydrogenase inhibitor

0.325 0.017 CHEMBL3544704

0.154 0.14 CHEMBL3544622

0.266 0.036 CHEMBL3559662

0.154 0.139 CHEMBL3544793

0.158 0.131 CHEMBL1614639

0.18 0.093 CHEMBL3544790

0.176 0.098 CHEMBL3544623

0.211 0.064 CHEMBL3544626

0.206 0.068 CHEMBL1741437

CHEMBL3544704
0.2070.3230.666Antiinflammatory

0.442 0.114 CHEMBL3544704

0.365 0.162 CHEMBL3544790

0.666 0.037 CHEMBL3544598

0.427 0.123 CHEMBL3544623

0.493 0.09 CHEMBL3544624

0.421 0.127 CHEMBL3544625

0.41 0.134 CHEMBL3544626

0.519 0.08 CHEMBL1741437

CHEMBL3544598
0.0890.2050.446DNA methyltransferase I inhibitor

0.446 0.006 CHEMBL3544704

0.181 0.079 CHEMBL3559662

0.249 0.047 CHEMBL3544790

0.213 0.063 CHEMBL3544625

0.154 0.1 CHEMBL3544626

0.148 0.106 CHEMBL1741437

CHEMBL3544704
0.0350.1520.25Phosphodiesterase IV inhibitor

0.129 0.029 CHEMBL3544718

0.077 0.065 CHEMBL3544719

0.074 0.068 CHEMBL578211

0.25 0.008 CHEMBL3544793

0.14 0.025 CHEMBL1741437

CHEMBL3544793
0.0160.1330.046Glycine transporter 2 inhibitor

0.046 0.033 CHEMBL3544626

CHEMBL3544626
0.030.1480.057Epithelial sodium channel blocker

0.052 0.044 CHEMBL3544721

0.057 0.033 CHEMBL3544626

CHEMBL3544626
0.0420.160.193Butyrylcholinesterase inhibitor

0.084 0.077 CHEMBL3544718

0.193 0.023 CHEMBL1190855

CHEMBL1190855
0.0170.1350.074Adenosine deaminase inhibitor

0.054 0.027 CHEMBL3544704

0.041 0.039 CHEMBL3544790

0.041 0.04 CHEMBL3544623

0.074 0.012 CHEMBL3544626

0.067 0.015 CHEMBL1741437

CHEMBL3544626
0.020.1390.156Tyrosine-protein kinase EMT inhibitor

0.059 0.038 CHEMBL3544721

0.156 0.008 CHEMBL3544622

0.055 0.042 CHEMBL3544600

CHEMBL3544622
0.0120.1310.028Vanilloid 2 agonist

0.028 0.013 CHEMBL3544626

CHEMBL3544626
0.0620.1850.227Microtubule formation inhibitor

0.102 0.088 CHEMBL3544719

0.122 0.058 CHEMBL3544623

0.227 0.014 CHEMBL3544624

0.133 0.048 CHEMBL3544625

0.105 0.082 CHEMBL1741437

CHEMBL3544624
0.020.1430.153Raf kinase B inhibitor

0.153 0.013 CHEMBL3544720

0.151 0.014 CHEMBL3544599

CHEMBL3544720
0.010.1340.045Glutamate (mGluR2) agonist

0.031 0.024 CHEMBL3544622

0.045 0.015 CHEMBL3544790

CHEMBL3544790
0.0780.2020.259Cell wall synthesis inhibitor

0.122 0.096 CHEMBL1190855

0.145 0.07 CHEMBL6200

0.136 0.08 CHEMBL3544704

0.183 0.038 CHEMBL3544719

0.121 0.098 CHEMBL3544721

0.183 0.038 CHEMBL3544622

0.149 0.066 CHEMBL3544791

0.198 0.031 CHEMBL3544790

0.15 0.065 CHEMBL3544600

0.259 0.014 CHEMBL3544598

0.187 0.036 CHEMBL3544623

0.177 0.042 CHEMBL3544624

0.243 0.017 CHEMBL3544625

0.155 0.061 CHEMBL3544626

0.147 0.068 CHEMBL1741437

CHEMBL3544598
0.0140.1380.051NMDA 2A receptor antagonist

0.051 0.037 CHEMBL1190855

CHEMBL1190855
0.0610.1850.174Nav1.4 sodium channel blocker

0.094 0.086 CHEMBL6200

0.174 0.025 CHEMBL3544719

0.094 0.086 CHEMBL3544622

0.121 0.051 CHEMBL3544623

0.109 0.063 CHEMBL3544626

0.099 0.077 CHEMBL1741437

CHEMBL3544719
0.0050.130.039Vasopressin 1A antagonist

0.039 0.015 CHEMBL3126023

CHEMBL3126023
0.0130.1390.058Glutamate (mGluR group II) agonist

0.035 0.024 CHEMBL3544622

0.058 0.013 CHEMBL3544790

0.035 0.024 CHEMBL3544626

0.033 0.026 CHEMBL1741437

CHEMBL3544790
0.0930.220.419Interleukin 6 antagonist

0.167 0.067 CHEMBL3544622

0.143 0.1 CHEMBL3544621

0.149 0.09 CHEMBL3544790

0.167 0.067 CHEMBL3544598

0.253 0.022 CHEMBL3544623

0.419 0.006 CHEMBL3544624

0.187 0.049 CHEMBL3544626

0.206 0.037 CHEMBL1741437

CHEMBL3544624
0.0130.140.098Purinergic P2Y antagonist

0.082 0.012 CHEMBL3544704

0.098 0.009 CHEMBL3544790

0.041 0.035 CHEMBL3544623

0.045 0.031 CHEMBL3544626

CHEMBL3544790
0.0310.1590.097Na+ K+ transporting ATPase inhibitor

0.076 0.054 CHEMBL3544598

0.083 0.047 CHEMBL3544623

0.097 0.035 CHEMBL3544624

0.07 0.06 CHEMBL3544625

0.081 0.05 CHEMBL3544626

0.069 0.061 CHEMBL1741437

CHEMBL3544624
0.0860.2150.132Neuropeptide Y1 antagonist

0.132 0.096 CHEMBL3544622

CHEMBL3544622
0.0410.170.114Glycine receptor antagonist

0.114 0.021 CHEMBL3544624

0.074 0.067 CHEMBL3544626

CHEMBL3544624
0.0050.1350.024Nicotinic acid receptor 1 antagonist

0.024 0.005 CHEMBL3544626

0.021 0.008 CHEMBL1741437

CHEMBL3544626
0.0220.1520.077Beta 2 adrenoreceptor antagonist

0.06 0.024 CHEMBL3544721

0.077 0.013 CHEMBL3544623

0.071 0.016 CHEMBL3544626

0.065 0.019 CHEMBL1741437

CHEMBL3544623
0.010.1420.038Gonadotropin-releasing hormone receptor antagonist

0.038 0.022 CHEMBL3544626

CHEMBL3544626
0.0090.1420.035Bradykinin B2 receptor agonist

0.035 0.014 CHEMBL3544625

CHEMBL3544625
0.0030.1370.017Aminopeptidase A inhibitor

0.017 0.013 CHEMBL3544626

0.017 0.014 CHEMBL1741437

CHEMBL1741437
0.0160.150.058Metalloproteinase-3 inhibitor

0.044 0.04 CHEMBL3544790

0.052 0.031 CHEMBL3544600

0.058 0.025 CHEMBL3544626

CHEMBL3544626
0.0070.1420.029Integrin beta5 antagonist

0.021 0.014 CHEMBL3544625

0.025 0.011 CHEMBL3544626

0.029 0.009 CHEMBL1741437

CHEMBL1741437
0.0170.1510.448Phosphodiesterase 4A inhibitor

0.448 0.004 CHEMBL3544793

CHEMBL3544793
0.0310.1660.096Beta adrenoreceptor antagonist

0.075 0.032 CHEMBL3544721

0.096 0.018 CHEMBL3544623

0.073 0.034 CHEMBL3544626

0.069 0.04 CHEMBL1741437

CHEMBL3544623
0.0610.1970.096T cell inhibitor

0.096 0.028 CHEMBL3544624

CHEMBL3544624
0.0840.220.184Sphingosine 1-phosphate receptor 2 antagonist

0.129 0.076 CHEMBL3544721

0.147 0.044 CHEMBL3544790

0.146 0.047 CHEMBL3544623

0.184 0.013 CHEMBL3544626

0.159 0.031 CHEMBL1741437

CHEMBL3544626
0.0510.1880.13Anabolic

0.112 0.048 CHEMBL3544790

0.126 0.034 CHEMBL3544623

0.095 0.07 CHEMBL3544624

0.1 0.062 CHEMBL3544625

0.13 0.031 CHEMBL3544626

0.111 0.049 CHEMBL1741437

CHEMBL3544626
0.080.2170.173Hexokinase inhibitor

0.156 0.072 CHEMBL3544704

0.125 0.111 CHEMBL3544790

0.173 0.055 CHEMBL3544598

0.158 0.07 CHEMBL3544625

0.151 0.077 CHEMBL3544626

0.166 0.061 CHEMBL1741437

CHEMBL3544598
0.010.1470.031Retinoid X beta receptor antagonist

0.023 0.01 CHEMBL3544790

0.02 0.017 CHEMBL3544623

0.031 0.004 CHEMBL3544625

0.026 0.006 CHEMBL3544626

0.025 0.007 CHEMBL1741437

CHEMBL3544625
0.0540.1920.174Adenylate cyclase inhibitor

0.174 0.032 CHEMBL3544704

0.101 0.084 CHEMBL3544622

0.101 0.083 CHEMBL3544790

CHEMBL3544704
0.0260.1640.157Raf kinase inhibitor

0.157 0.018 CHEMBL3544720

0.156 0.018 CHEMBL3544599

CHEMBL3544720
0.1040.2420.15CC chemokine 6 receptor antagonist

0.127 0.084 CHEMBL3544704

0.15 0.023 CHEMBL3544598

CHEMBL3544598
0.0160.1550.058Membrane dipeptidase inhibitor

0.043 0.022 CHEMBL3544790

0.058 0.011 CHEMBL3544623

0.05 0.015 CHEMBL3544625

0.056 0.012 CHEMBL3544626

0.045 0.02 CHEMBL1741437

CHEMBL3544623
0.0090.1470.055Methionyl aminopeptidase 1 inhibitor

0.034 0.019 CHEMBL3544622

0.029 0.027 CHEMBL3544600

0.035 0.017 CHEMBL3544623

0.034 0.019 CHEMBL3544625

0.055 0.005 CHEMBL3544626

0.043 0.009 CHEMBL1741437

CHEMBL3544626
0.090.2290.181P-glycoprotein inhibitor

0.161 0.1 CHEMBL3544721

0.168 0.092 CHEMBL3544790

0.151 0.115 CHEMBL3544623

0.181 0.079 CHEMBL3544625

CHEMBL3544625
0.0250.1640.066Cyclin B1 inhibitor

0.066 0.037 CHEMBL3544719

CHEMBL3544719
0.0060.1460.069Leukotriene A4 hydrolase inhibitor

0.069 0.012 CHEMBL3544626

CHEMBL3544626
0.0830.2240.26Insulin secretagoues

0.195 0.038 CHEMBL6200

0.204 0.034 CHEMBL3544704

0.151 0.073 CHEMBL3544719

0.133 0.093 CHEMBL3544793

0.194 0.039 CHEMBL3544790

0.197 0.038 CHEMBL3544598

0.165 0.06 CHEMBL3544623

0.15 0.075 CHEMBL3544625

0.26 0.018 CHEMBL3544626

0.256 0.018 CHEMBL1741437

CHEMBL3544626
0.0240.1650.088Glucose-6-phosphate isomerase inhibitor

0.088 0.007 CHEMBL3544790

0.087 0.007 CHEMBL3544623

0.048 0.033 CHEMBL3544624

0.08 0.009 CHEMBL3544625

0.088 0.007 CHEMBL3544626

0.075 0.01 CHEMBL1741437

CHEMBL3544626
0.0380.180.066Immunoglobulin Fc receptor antagonist

0.054 0.041 CHEMBL3544721

0.061 0.022 CHEMBL3544622

0.066 0.015 CHEMBL3544600

0.063 0.02 CHEMBL3544626

0.059 0.026 CHEMBL1741437

CHEMBL3544600
0.0680.2090.274Interleukin 1 antagonist

0.192 0.036 CHEMBL3544622

0.146 0.06 CHEMBL3544621

0.158 0.052 CHEMBL3544790

0.273 0.014 CHEMBL3544623

0.274 0.014 CHEMBL3544625

0.138 0.067 CHEMBL3544626

0.194 0.035 CHEMBL1741437

CHEMBL3544625
0.0650.2080.183TRPA1 agonist

0.12 0.058 CHEMBL3544790

0.098 0.092 CHEMBL3544623

0.145 0.035 CHEMBL3544625

0.183 0.015 CHEMBL3544626

0.145 0.035 CHEMBL1741437

CHEMBL3544626
0.0220.1650.228Biliverdin reductase inhibitor

0.126 0.013 CHEMBL3544704

0.09 0.022 CHEMBL3544622

0.067 0.034 CHEMBL3559662

0.146 0.01 CHEMBL3544790

0.15 0.009 CHEMBL3544623

0.178 0.007 CHEMBL3544625

0.228 0.005 CHEMBL3544626

0.195 0.006 CHEMBL1741437

CHEMBL3544626
0.020.1640.07Glutamate (mGluR8) agonist

0.068 0.005 CHEMBL3544790

0.057 0.008 CHEMBL3544623

0.055 0.009 CHEMBL3544625

0.07 0.005 CHEMBL3544626

0.06 0.007 CHEMBL1741437

CHEMBL3544626
0.0120.1570.073Histone deacetylase 8 inhibitor

0.06 0.017 CHEMBL3544721

0.06 0.016 CHEMBL3544622

0.073 0.012 CHEMBL3544600

0.036 0.033 CHEMBL3544625

CHEMBL3544600
0.020.1670.04GHS receptor agonist

0.04 0.035 CHEMBL6200

CHEMBL6200
0.0260.1730.073Glucose-6-phosphate translocase inhibitor

0.05 0.039 CHEMBL3544704

0.069 0.016 CHEMBL3544598

0.073 0.014 CHEMBL3544625

0.047 0.045 CHEMBL3544626

CHEMBL3544625
0.0180.1660.091Acyl-CoA dehydrogenase inhibitor

0.057 0.036 CHEMBL3544622

0.06 0.033 CHEMBL3544790

0.062 0.032 CHEMBL3544623

0.07 0.027 CHEMBL3544625

0.071 0.026 CHEMBL3544626

0.091 0.019 CHEMBL1741437

CHEMBL1741437
0.0050.1530.034Vasopressin 1 antagonist

0.034 0.021 CHEMBL3126023

CHEMBL3126023
0.0310.1790.081Cathepsin G inhibitor

0.065 0.06 CHEMBL3544623

0.081 0.043 CHEMBL3544626

0.072 0.051 CHEMBL1741437

CHEMBL3544626
0.0260.1740.102Acetyl-CoA transferase 2 inhibitor

0.102 0.005 CHEMBL3544624

CHEMBL3544624
0.0040.1520.052AMPA 1 receptor antagonist

0.03 0.02 CHEMBL3544626

0.052 0.01 CHEMBL1741437

CHEMBL1741437
0.1290.2790.232Neuropeptide Y2 antagonist

0.232 0.074 CHEMBL3544622

0.177 0.165 CHEMBL3544600

CHEMBL3544622
0.0990.2490.141MAP kinase kinase 4 inhibitor

0.141 0.082 CHEMBL6200

0.13 0.114 CHEMBL3544599

CHEMBL6200
0.0750.2250.232Arachidonic acid antagonist

0.133 0.109 CHEMBL3544622

0.219 0.018 CHEMBL3544790

0.127 0.117 CHEMBL3544600

0.201 0.032 CHEMBL3544623

0.185 0.048 CHEMBL3544624

0.195 0.038 CHEMBL3544625

0.215 0.02 CHEMBL3544626

0.232 0.011 CHEMBL1741437

CHEMBL1741437
0.0610.2110.23DOPA decarboxylase inhibitor

0.115 0.051 CHEMBL3544622

0.153 0.02 CHEMBL3544790

0.119 0.046 CHEMBL3544623

0.128 0.036 CHEMBL3544625

0.174 0.012 CHEMBL3544626

0.23 0.004 CHEMBL1741437

CHEMBL1741437
0.0270.1770.093Botulinum neurotoxin type A inhibitor

0.059 0.038 CHEMBL3544721

0.054 0.048 CHEMBL3544622

0.06 0.038 CHEMBL3544790

0.063 0.034 CHEMBL3544623

0.081 0.017 CHEMBL3544625

0.074 0.021 CHEMBL3544626

0.093 0.011 CHEMBL1741437

CHEMBL1741437
0.0460.1980.267UDP-glucose 4-epimerase inhibitor

0.258 0.013 CHEMBL3544704

0.088 0.076 CHEMBL3544719

0.267 0.012 CHEMBL3559662

0.098 0.063 CHEMBL1614639

0.12 0.043 CHEMBL3544790

0.159 0.026 CHEMBL3544598

0.096 0.065 CHEMBL3544623

0.108 0.053 CHEMBL3544624

0.089 0.074 CHEMBL3544625

0.104 0.057 CHEMBL3544626

0.146 0.03 CHEMBL1741437

CHEMBL3559662
0.0190.1720.154Argininosuccinate synthase inhibitor

0.087 0.023 CHEMBL3544704

0.054 0.042 CHEMBL3544622

0.071 0.029 CHEMBL3559662

0.154 0.011 CHEMBL3544790

0.106 0.018 CHEMBL3544623

0.102 0.019 CHEMBL3544625

0.135 0.013 CHEMBL3544626

0.134 0.013 CHEMBL1741437

CHEMBL3544790
0.010.1640.031Lysophosphatidic acid receptor 1 agonist

0.024 0.02 CHEMBL3544623

0.031 0.01 CHEMBL3544626

0.029 0.011 CHEMBL1741437

CHEMBL3544626
0.0030.1580.02Carbonic anhydrase X inhibitor

0.015 0.014 CHEMBL3544622

0.017 0.011 CHEMBL3544790

0.016 0.012 CHEMBL3544623

0.02 0.009 CHEMBL3544626

CHEMBL3544626
0.0030.1580.02Carbonic anhydrase VIII inhibitor

0.015 0.014 CHEMBL3544622

0.017 0.011 CHEMBL3544790

0.016 0.012 CHEMBL3544623

0.02 0.009 CHEMBL3544626

CHEMBL3544626
0.0040.1580.02Integrin beta7 antagonist

0.02 0.014 CHEMBL1741437

CHEMBL1741437
0.0060.1620.022S-adenosyl-L-homocysteine hydrolase inhibitor

0.022 0.006 CHEMBL3544704

0.016 0.009 CHEMBL3559662

CHEMBL3544704
0.030.1870.101NAD(P)H dehydrogenase (quinone) inhibitor

0.101 0.037 CHEMBL3544790

0.07 0.061 CHEMBL3544624

0.09 0.044 CHEMBL3544625

0.077 0.054 CHEMBL3544626

0.073 0.057 CHEMBL1741437

CHEMBL3544790
0.0490.2070.137NADH dehydrogenase inhibitor

0.127 0.025 CHEMBL3544704

0.087 0.062 CHEMBL3559662

0.102 0.041 CHEMBL3544790

0.103 0.041 CHEMBL3544598

0.103 0.041 CHEMBL3544623

0.081 0.072 CHEMBL3544624

0.098 0.046 CHEMBL3544625

0.107 0.037 CHEMBL3544626

0.137 0.021 CHEMBL1741437

CHEMBL1741437
0.0520.2090.201AMP-activated protein kinase stimulant

0.183 0.014 CHEMBL3544704

0.201 0.011 CHEMBL3544598

0.114 0.054 CHEMBL3544626

0.142 0.033 CHEMBL1741437

CHEMBL3544598
0.0260.1840.238Histone deacetylase inhibitor

0.153 0.008 CHEMBL3544721

0.155 0.008 CHEMBL3544622

0.068 0.042 CHEMBL3544790

0.238 0.005 CHEMBL3544600

0.125 0.011 CHEMBL3544625

CHEMBL3544600
0.0640.2220.166Antibacterial (Helicobacter pylori)

0.158 0.04 CHEMBL3544721

0.125 0.073 CHEMBL3544622

0.142 0.053 CHEMBL3544790

0.159 0.04 CHEMBL3544600

0.165 0.036 CHEMBL3544623

0.11 0.097 CHEMBL3544625

0.165 0.035 CHEMBL3544626

0.166 0.035 CHEMBL1741437

CHEMBL1741437
0.0360.1940.222Glutamate dehydrogenase inhibitor

0.131 0.02 CHEMBL3544704

0.071 0.055 CHEMBL3544721

0.145 0.017 CHEMBL3544622

0.079 0.045 CHEMBL3559662

0.209 0.009 CHEMBL3544790

0.077 0.048 CHEMBL3544600

0.198 0.01 CHEMBL3544623

0.175 0.012 CHEMBL3544625

0.222 0.009 CHEMBL3544626

0.166 0.013 CHEMBL1741437

CHEMBL3544626
0.0080.1670.035Phosphoglycerate kinase inhibitor

0.034 0.026 CHEMBL3544623

0.035 0.024 CHEMBL3544626

0.032 0.029 CHEMBL1741437

CHEMBL3544626
0.0060.1640.035Purinergic P2X agonist

0.035 0.015 CHEMBL3544704

0.035 0.015 CHEMBL3559662

CHEMBL3559662
0.0410.1990.063Transcription factor RelA inhibitor

0.063 0.045 CHEMBL3544624

CHEMBL3544624
0.1370.2950.631Antiobesity

0.631 0.017 CHEMBL3544718

0.523 0.033 CHEMBL3544598

0.478 0.042 CHEMBL3544623

0.278 0.133 CHEMBL1741437

CHEMBL3544718
0.0880.2470.396Immunostimulant

0.396 0.051 CHEMBL3544704

0.167 0.141 CHEMBL3544622

0.205 0.117 CHEMBL3559662

0.187 0.129 CHEMBL3544790

0.369 0.059 CHEMBL3544598

0.336 0.068 CHEMBL3544623

0.154 0.152 CHEMBL3544625

0.332 0.07 CHEMBL3544626

0.254 0.094 CHEMBL1741437

CHEMBL3544704
0.0320.1910.161Protein kinase (Mos, Mil/Raf, MEKK, RIPK, TESK, LIMK, IRAK, ILK, Activin/TGF-beta) inhibitor

0.161 0.025 CHEMBL3544720

0.157 0.026 CHEMBL3544599

CHEMBL3544720
0.0210.1810.049Cholesterol esterase inhibitor

0.044 0.039 CHEMBL3544626

0.049 0.031 CHEMBL1741437

CHEMBL1741437
0.0070.1680.043Integrin alphaVbeta3 antagonist

0.023 0.013 CHEMBL3544790

0.021 0.016 CHEMBL3544623

0.02 0.017 CHEMBL3544625

0.043 0.005 CHEMBL3544626

0.032 0.007 CHEMBL1741437

CHEMBL3544626
0.0090.1710.095Fumarate hydratase inhibitor

0.037 0.021 CHEMBL3544704

0.082 0.007 CHEMBL3544790

0.082 0.007 CHEMBL3544623

0.074 0.008 CHEMBL3544625

0.095 0.006 CHEMBL3544626

0.067 0.009 CHEMBL1741437

CHEMBL3544626
0.0150.1770.058Adenosine A1 receptor antagonist

0.058 0.041 CHEMBL3544704

CHEMBL3544704
0.010.1720.019Methylmalonyl-CoA mutase inhibitor

0.018 0.014 CHEMBL3544790

0.018 0.013 CHEMBL3544623

0.019 0.011 CHEMBL3544626

0.017 0.015 CHEMBL1741437

CHEMBL3544626
0.0340.1980.079Interferon inducer

0.079 0.025 CHEMBL3544626

0.072 0.032 CHEMBL1741437

CHEMBL3544626
0.0110.1750.049Lysophosphatidic acid 2 receptor antagonist

0.033 0.018 CHEMBL3544790

0.049 0.009 CHEMBL3544623

0.031 0.02 CHEMBL3544626

0.03 0.022 CHEMBL1741437

CHEMBL3544623
0.020.1840.221Phosphofructokinase-1 inhibitor

0.146 0.019 CHEMBL3544704

0.077 0.043 CHEMBL3559662

0.206 0.01 CHEMBL3544790

0.096 0.033 CHEMBL3544598

0.207 0.01 CHEMBL3544623

0.146 0.019 CHEMBL3544624

0.182 0.013 CHEMBL3544625

0.221 0.009 CHEMBL3544626

0.179 0.013 CHEMBL1741437

CHEMBL3544626
0.0280.1940.095Sodium/calcium exchanger inhibitor

0.095 0.005 CHEMBL3544624

CHEMBL3544624
0.0390.2050.413Platelet activating factor antagonist

0.136 0.053 CHEMBL3544793

0.413 0.005 CHEMBL3544624

0.113 0.068 CHEMBL3544626

CHEMBL3544624
0.0160.1840.048Retinoid X alpha receptor antagonist

0.041 0.014 CHEMBL3544790

0.045 0.009 CHEMBL3544625

0.037 0.019 CHEMBL3544626

0.048 0.008 CHEMBL1741437

CHEMBL1741437
0.0070.1750.104Antidiuretic hormone antagonist

0.104 0.012 CHEMBL3126023

CHEMBL3126023
0.0080.1760.046Histone deacetylase 4 inhibitor

0.036 0.019 CHEMBL3544721

0.038 0.019 CHEMBL3544622

0.046 0.014 CHEMBL3544600

0.031 0.023 CHEMBL3544625

CHEMBL3544600
0.0120.1810.079Ornithine carbamoyltransferase inhibitor

0.047 0.042 CHEMBL3544704

0.079 0.022 CHEMBL3544622

0.069 0.026 CHEMBL3544790

0.058 0.033 CHEMBL3544623

0.063 0.029 CHEMBL3544625

0.067 0.027 CHEMBL3544626

0.079 0.022 CHEMBL1741437

CHEMBL1741437
0.0030.1720.026Kainate receptor 1 antagonist

0.026 0.012 CHEMBL3544625

0.021 0.015 CHEMBL1741437

CHEMBL3544625
0.0170.1860.059Cyclin B2 inhibitor

0.059 0.033 CHEMBL3544719

CHEMBL3544719
0.1370.3070.475Apoptosis antagonist

0.475 0.024 CHEMBL1190855

0.297 0.088 CHEMBL3544704

0.44 0.029 CHEMBL3544791

0.251 0.127 CHEMBL3559662

0.197 0.184 CHEMBL3544793

0.356 0.053 CHEMBL3544790

0.393 0.04 CHEMBL3544598

0.286 0.095 CHEMBL3544623

0.205 0.173 CHEMBL3544624

0.366 0.049 CHEMBL3544625

0.38 0.044 CHEMBL3544626

0.232 0.145 CHEMBL1741437

CHEMBL1190855
0.0070.1780.039Kinesin-like protein 1 inhibitor

0.039 0.023 CHEMBL3544718

CHEMBL3544718
0.0070.1780.039Kinesin antagonist

0.039 0.023 CHEMBL3544718

CHEMBL3544718
0.0110.1810.134Oxytocin antagonist

0.134 0.007 CHEMBL3126023

0.038 0.026 CHEMBL3544719

CHEMBL3126023
0.0310.2030.091Protease 3C (Human rhinovirus) inhibitor

0.091 0.02 CHEMBL3544622

0.07 0.037 CHEMBL3544600

CHEMBL3544622
0.1770.350.5625 Hydroxytryptamine release inhibitor

0.273 0.198 CHEMBL6200

0.318 0.146 CHEMBL3544719

0.281 0.188 CHEMBL3544721

0.385 0.088 CHEMBL3544622

0.472 0.042 CHEMBL3544790

0.315 0.148 CHEMBL3544600

0.257 0.219 CHEMBL3544598

0.471 0.043 CHEMBL3544623

0.329 0.134 CHEMBL3544624

0.371 0.098 CHEMBL3544625

0.562 0.017 CHEMBL3544626

0.512 0.029 CHEMBL1741437

CHEMBL3544626
0.0580.230.131Interleukin 12 antagonist

0.13 0.021 CHEMBL3544719

0.102 0.051 CHEMBL578211

0.12 0.029 CHEMBL3544622

0.106 0.045 CHEMBL3544790

0.088 0.077 CHEMBL3544598

0.094 0.065 CHEMBL3544623

0.089 0.075 CHEMBL3544624

0.093 0.065 CHEMBL3544625

0.131 0.021 CHEMBL3544626

0.092 0.068 CHEMBL1741437

CHEMBL3544626
0.0080.180.174Urate transporter 1 inhibitor

0.071 0.01 CHEMBL3544790

0.068 0.011 CHEMBL3544623

0.047 0.02 CHEMBL3544625

0.137 0.004 CHEMBL3544626

0.174 0.004 CHEMBL1741437

CHEMBL1741437
0.0170.1920.055Retinoid X receptor antagonist

0.049 0.013 CHEMBL3544790

0.054 0.01 CHEMBL3544625

0.045 0.017 CHEMBL3544626

0.055 0.009 CHEMBL1741437

CHEMBL1741437
0.0340.2090.07Beta 3 adrenoreceptor antagonist

0.07 0.034 CHEMBL3544721

0.064 0.046 CHEMBL3544623

CHEMBL3544721
0.0130.1890.053Stearoyl-CoA desaturase inhibitor

0.044 0.03 CHEMBL3544623

0.043 0.032 CHEMBL3544626

0.053 0.021 CHEMBL1741437

CHEMBL1741437
0.0580.2350.269Adenylate kinase inhibitor

0.126 0.039 CHEMBL3544704

0.091 0.085 CHEMBL3559662

0.192 0.016 CHEMBL3544790

0.212 0.013 CHEMBL3544623

0.166 0.021 CHEMBL3544625

0.208 0.014 CHEMBL3544626

0.269 0.009 CHEMBL1741437

CHEMBL1741437
0.0020.1790.017Glutamate (mGluR6) agonist

0.012 0.008 CHEMBL3544790

0.011 0.01 CHEMBL3544623

0.017 0.005 CHEMBL3544626

0.012 0.009 CHEMBL1741437

CHEMBL3544626
0.0040.1820.041Integrin alpha4beta7 antagonist

0.018 0.017 CHEMBL3544623

0.027 0.01 CHEMBL3544626

0.041 0.006 CHEMBL1741437

CHEMBL1741437
0.0280.2050.055Antiviral (Hepatitis D)

0.054 0.03 CHEMBL578211

0.048 0.04 CHEMBL3544791

0.055 0.029 CHEMBL1614639

CHEMBL1614639
0.0070.1850.072Kainate receptor antagonist

0.067 0.013 CHEMBL3544625

0.047 0.023 CHEMBL3544626

0.072 0.012 CHEMBL1741437

CHEMBL1741437
0.0860.2640.141CF transmembrane conductance regulator agonist

0.141 0.093 CHEMBL3544626

CHEMBL3544626
0.0030.1820.019Ileal bile acid transport inhibitor

0.019 0.01 CHEMBL3544626

CHEMBL3544626
0.0020.1810.027Thromboxane agonist

0.027 0.003 CHEMBL3544623

0.013 0.006 CHEMBL3544625

0.018 0.004 CHEMBL3544626

CHEMBL3544623
0.0170.1970.088Lysophosphatidic acid 3 receptor antagonist

0.072 0.013 CHEMBL3544790

0.048 0.039 CHEMBL3544600

0.08 0.009 CHEMBL3544623

0.066 0.017 CHEMBL3544625

0.085 0.008 CHEMBL3544626

0.088 0.007 CHEMBL1741437

CHEMBL1741437
0.0220.2030.112Sphingosine 1-phosphate receptor 3 antagonist

0.06 0.038 CHEMBL6200

0.074 0.021 CHEMBL3544721

0.074 0.022 CHEMBL3544622

0.09 0.011 CHEMBL3544790

0.059 0.039 CHEMBL3544600

0.088 0.012 CHEMBL3544623

0.112 0.005 CHEMBL3544626

0.085 0.014 CHEMBL1741437

CHEMBL3544626
0.0180.20.05Cyclin B inhibitor

0.05 0.045 CHEMBL3544719

CHEMBL3544719
0.0250.2080.051Angiotensin-converting enzyme inhibitor

0.051 0.044 CHEMBL3544626

CHEMBL3544626
0.0190.2010.097Glutamate (mGluR group III) agonist

0.078 0.013 CHEMBL3544790

0.057 0.019 CHEMBL3544623

0.06 0.018 CHEMBL3544625

0.097 0.01 CHEMBL3544626

0.078 0.013 CHEMBL1741437

CHEMBL3544626
0.0150.1980.105Sphingosine 1-phosphate receptor agonist

0.073 0.01 CHEMBL3544790

0.049 0.026 CHEMBL3544623

0.105 0.005 CHEMBL3544626

0.068 0.012 CHEMBL1741437

CHEMBL3544626
0.0330.2190.102Interferon agonist

0.075 0.06 CHEMBL3544721

0.075 0.061 CHEMBL3544622

0.095 0.034 CHEMBL3544790

0.102 0.027 CHEMBL3544626

0.087 0.042 CHEMBL1741437

CHEMBL3544626
0.0570.2430.242Photosensitizer

0.166 0.023 CHEMBL3544790

0.176 0.019 CHEMBL3544623

0.1 0.089 CHEMBL3544624

0.134 0.043 CHEMBL3544625

0.242 0.007 CHEMBL3544626

0.162 0.025 CHEMBL1741437

CHEMBL3544626
0.0290.2160.092Stem cell growth factor agonist

0.092 0.052 CHEMBL3544721

CHEMBL3544721
0.0280.2140.147Potassium channel (ATP-sensitive) blocker

0.147 0.005 CHEMBL3544721

0.102 0.015 CHEMBL3544622

0.091 0.02 CHEMBL3544790

0.115 0.01 CHEMBL3544600

0.062 0.056 CHEMBL1741437

CHEMBL3544721
0.0590.2460.268Cell adhesion inhibitor

0.172 0.034 CHEMBL3544790

0.2 0.024 CHEMBL3544598

0.157 0.042 CHEMBL3544623

0.268 0.013 CHEMBL3544625

0.262 0.014 CHEMBL3544626

0.262 0.013 CHEMBL1741437

CHEMBL3544625
0.010.1980.035Inosine monophosphate dehydrogenase inhibitor

0.035 0.027 CHEMBL3544625

0.033 0.03 CHEMBL3544626

CHEMBL3544625
0.0360.2230.085Potassium channel activator

0.085 0.067 CHEMBL3544719

CHEMBL3544719
0.0390.2260.22Topoisomerase II inhibitor

0.102 0.084 CHEMBL6200

0.22 0.029 CHEMBL3544598

CHEMBL3544598
0.0450.2320.122Bile acid receptor antagonist

0.122 0.018 CHEMBL3544790

0.097 0.055 CHEMBL3544623

0.093 0.066 CHEMBL3544625

0.12 0.019 CHEMBL3544626

0.121 0.019 CHEMBL1741437

CHEMBL3544790
0.0270.2170.065Epoxide hydrolase inhibitor

0.065 0.061 CHEMBL3544626

CHEMBL3544626
0.0380.2270.261Keratolytic

0.07 0.064 CHEMBL3544622

0.12 0.021 CHEMBL3544790

0.112 0.024 CHEMBL3544623

0.261 0.005 CHEMBL3544625

0.166 0.012 CHEMBL3544626

0.158 0.013 CHEMBL1741437

CHEMBL3544625
0.0080.1980.075Liver X receptor beta antagonist

0.027 0.022 CHEMBL3544790

0.044 0.01 CHEMBL3544623

0.054 0.007 CHEMBL3544626

0.075 0.004 CHEMBL1741437

CHEMBL1741437
0.0080.1980.022Motilin receptor agonist

0.022 0.017 CHEMBL3544598

CHEMBL3544598
0.010.20.06Matrix metalloproteinase 1 inhibitor

0.06 0.031 CHEMBL3544600

CHEMBL3544600
0.0150.2060.056Glutamate (mGluR4) agonist

0.056 0.009 CHEMBL3544790

0.035 0.022 CHEMBL3544623

0.046 0.012 CHEMBL3544625

0.053 0.01 CHEMBL3544626

0.049 0.011 CHEMBL1741437

CHEMBL3544790
0.0130.2040.033RNA-directed RNA polymerase inhibitor

0.033 0.025 CHEMBL3544790

CHEMBL3544790
0.010.2010.051Histone deacetylase class IV inhibitor

0.036 0.019 CHEMBL3544721

0.039 0.018 CHEMBL3544622

0.051 0.013 CHEMBL3544600

0.031 0.022 CHEMBL3544625

CHEMBL3544600
0.010.2010.051Histone deacetylase 11 inhibitor

0.036 0.019 CHEMBL3544721

0.039 0.018 CHEMBL3544622

0.051 0.013 CHEMBL3544600

0.031 0.022 CHEMBL3544625

CHEMBL3544600
0.0020.1950.015Angiotensin AT1B receptor antagonist

0.015 0.008 CHEMBL3544626

0.015 0.009 CHEMBL1741437

CHEMBL1741437
0.0040.1960.043VLA-4 antagonist

0.025 0.019 CHEMBL3544626

0.043 0.014 CHEMBL1741437

CHEMBL1741437
0.0520.2460.089Carbonic anhydrase XV inhibitor

0.089 0.085 CHEMBL1741437

CHEMBL1741437
0.0080.2030.082Sphingosine 1-phosphate receptor 1 agonist

0.06 0.013 CHEMBL3544790

0.046 0.024 CHEMBL3544623

0.082 0.005 CHEMBL3544626

0.056 0.015 CHEMBL1741437

CHEMBL3544626
0.0480.2440.151CDC-like kinase 2 inhibitor

0.151 0.092 CHEMBL6200

CHEMBL6200
0.0190.2150.061Purinergic P2 antagonist

0.061 0.047 CHEMBL3544790

CHEMBL3544790
0.10.2970.213Growth factor agonist

0.213 0.052 CHEMBL3544721

0.184 0.081 CHEMBL3544622

0.171 0.1 CHEMBL3544790

0.187 0.077 CHEMBL3544600

0.156 0.128 CHEMBL3544623

0.175 0.093 CHEMBL3544626

0.191 0.072 CHEMBL1741437

CHEMBL3544721
0.0460.2450.175Carbonic anhydrase III inhibitor

0.085 0.082 CHEMBL3544622

0.115 0.048 CHEMBL3544790

0.175 0.021 CHEMBL3544623

0.121 0.044 CHEMBL3544624

0.126 0.04 CHEMBL3544625

0.135 0.035 CHEMBL3544626

0.111 0.051 CHEMBL1741437

CHEMBL3544623
0.0170.2160.053Matrix metalloproteinase (membrane-type) inhibitor

0.053 0.041 CHEMBL3544626

CHEMBL3544626
0.020.2190.215Catalase inhibitor

0.071 0.054 CHEMBL3544622

0.206 0.014 CHEMBL3544790

0.215 0.013 CHEMBL3544623

0.204 0.014 CHEMBL3544625

0.194 0.016 CHEMBL3544626

0.215 0.013 CHEMBL1741437

CHEMBL1741437
0.0170.2170.117Neuropeptide agonist

0.117 0.023 CHEMBL3544622

CHEMBL3544622
0.0080.2070.021Caspase 8 inhibitor

0.021 0.011 CHEMBL3544790

0.021 0.011 CHEMBL3544626

CHEMBL3544626
0.1250.3250.684Toll-Like receptor 7 agonist

0.684 0.01 CHEMBL3544793

0.506 0.031 CHEMBL3544623

0.252 0.146 CHEMBL3544625

0.465 0.039 CHEMBL3544626

0.635 0.014 CHEMBL1741437

CHEMBL3544793
0.0370.2380.119Glutamate (mGluR6) antagonist

0.092 0.014 CHEMBL3544790

0.097 0.012 CHEMBL3544623

0.078 0.026 CHEMBL3544625

0.119 0.005 CHEMBL3544626

0.091 0.015 CHEMBL1741437

CHEMBL3544626
0.0180.220.068Collagenase 3 inhibitor

0.068 0.033 CHEMBL3544626

0.06 0.041 CHEMBL1741437

CHEMBL3544626
0.0080.2110.084Histone deacetylase 2 inhibitor

0.04 0.018 CHEMBL3544721

0.058 0.013 CHEMBL3544622

0.084 0.011 CHEMBL3544600

0.039 0.019 CHEMBL3544625

CHEMBL3544600
0.0360.2390.146DNA intercalator

0.094 0.081 CHEMBL1190855

0.123 0.056 CHEMBL3544791

0.146 0.044 CHEMBL3544598

CHEMBL3544598
0.0220.2270.058Integrin alpha1beta1 antagonist

0.04 0.021 CHEMBL3544790

0.037 0.03 CHEMBL3544623

0.058 0.005 CHEMBL3544625

0.043 0.015 CHEMBL3544626

0.037 0.031 CHEMBL1741437

CHEMBL3544625
0.1170.3240.399Peptidyltransferase inhibitor

0.375 0.009 CHEMBL3544704

0.212 0.085 CHEMBL3544719

0.309 0.022 CHEMBL3544721

0.328 0.016 CHEMBL3559662

0.223 0.073 CHEMBL1614639

0.169 0.148 CHEMBL3544790

0.182 0.126 CHEMBL3544600

0.399 0.007 CHEMBL3544598

0.273 0.036 CHEMBL3544623

0.225 0.071 CHEMBL3544625

0.185 0.121 CHEMBL3544626

0.203 0.096 CHEMBL1741437

CHEMBL3544598
0.0760.2840.7Platelet aggregation inhibitor

0.16 0.117 CHEMBL3544721

0.199 0.081 CHEMBL3544793

0.188 0.091 CHEMBL1614639

0.418 0.017 CHEMBL3544790

0.148 0.131 CHEMBL3544600

0.372 0.022 CHEMBL3544623

0.7 0.005 CHEMBL3544624

0.342 0.027 CHEMBL3544625

0.643 0.005 CHEMBL3544626

0.578 0.005 CHEMBL1741437

CHEMBL3544624
0.0240.2330.121Androgen antagonist

0.092 0.053 CHEMBL3544719

0.093 0.052 CHEMBL578211

0.093 0.052 CHEMBL3544791

0.121 0.033 CHEMBL1614639

0.105 0.043 CHEMBL3544624

CHEMBL1614639
0.0180.2280.051Bombesin antagonist

0.051 0.028 CHEMBL3544622

CHEMBL3544622
0.050.260.082D-Ala-D-Ala ligase inhibitor

0.082 0.064 CHEMBL1741437

CHEMBL1741437
0.0070.2180.04Prostaglandin F2 alpha agonist

0.024 0.014 CHEMBL3544790

0.027 0.01 CHEMBL3544623

0.029 0.01 CHEMBL3544625

0.04 0.005 CHEMBL3544626

0.023 0.015 CHEMBL1741437

CHEMBL3544626
0.0560.2670.231Anticoagulant

0.195 0.055 CHEMBL3544793

0.231 0.043 CHEMBL3544598

0.198 0.054 CHEMBL3544626

0.18 0.061 CHEMBL1741437

CHEMBL3544598
0.0050.2170.171Kynurenine 3 monooxygenase inhibitor

0.171 0.003 CHEMBL3544790

0.059 0.005 CHEMBL3544623

0.043 0.009 CHEMBL3544625

0.077 0.004 CHEMBL3544626

0.076 0.004 CHEMBL1741437

CHEMBL3544790
0.0440.2570.162Mucolytic

0.13 0.046 CHEMBL3544790

0.144 0.036 CHEMBL3544623

0.1 0.078 CHEMBL3544624

0.107 0.068 CHEMBL3544625

0.13 0.046 CHEMBL3544626

0.162 0.026 CHEMBL1741437

CHEMBL1741437
0.0340.2480.184Mediator release inhibitor

0.086 0.085 CHEMBL3544721

0.102 0.068 CHEMBL3544622

0.138 0.034 CHEMBL3544790

0.184 0.018 CHEMBL3544623

0.166 0.022 CHEMBL3544625

0.158 0.025 CHEMBL3544626

0.136 0.036 CHEMBL1741437

CHEMBL3544623
0.1190.3370.677Toll-Like receptor agonist

0.677 0.01 CHEMBL3544793

0.512 0.029 CHEMBL3544623

0.249 0.149 CHEMBL3544625

0.484 0.035 CHEMBL3544626

0.633 0.014 CHEMBL1741437

CHEMBL3544793
0.0380.2560.218Uric acid excretion stimulant

0.126 0.034 CHEMBL3544704

0.102 0.051 CHEMBL3544790

0.084 0.076 CHEMBL3544598

0.085 0.074 CHEMBL3544623

0.125 0.035 CHEMBL3544625

0.174 0.017 CHEMBL3544626

0.218 0.011 CHEMBL1741437

CHEMBL1741437
0.0050.2240.016Vitamin D receptor agonist

0.016 0.012 CHEMBL3544623

0.016 0.012 CHEMBL3544626

0.015 0.014 CHEMBL1741437

CHEMBL3544626
0.0190.2380.0533-Hydroxyanthranilate 3,4-dioxygenase inhibitor

0.04 0.032 CHEMBL3544790

0.053 0.012 CHEMBL3544626

0.05 0.015 CHEMBL1741437

CHEMBL3544626
0.0190.240.185Sphingosine 1-phosphate receptor 4 agonist

0.112 0.02 CHEMBL3544790

0.106 0.022 CHEMBL3544623

0.133 0.012 CHEMBL3544625

0.185 0.005 CHEMBL3544626

0.155 0.008 CHEMBL1741437

CHEMBL3544626
0.0630.2850.154Sphingosine 1-phosphate receptor 4 antagonist

0.116 0.079 CHEMBL6200

0.11 0.093 CHEMBL3544790

0.112 0.089 CHEMBL3544625

0.154 0.03 CHEMBL3544626

0.14 0.043 CHEMBL1741437

CHEMBL3544626
0.0060.2290.068Glucagon receptor antagonist

0.028 0.022 CHEMBL3544790

0.068 0.006 CHEMBL3544623

0.051 0.01 CHEMBL3544626

CHEMBL3544623
0.0630.2870.155Thiol protease inhibitor

0.141 0.078 CHEMBL3544622

0.155 0.064 CHEMBL3544626

CHEMBL3544626
0.0510.2770.17Toll-Like receptor 2 antagonist

0.152 0.051 CHEMBL3544790

0.124 0.074 CHEMBL3544623

0.125 0.073 CHEMBL3544625

0.17 0.039 CHEMBL3544626

0.125 0.072 CHEMBL1741437

CHEMBL3544626
0.0040.2310.062Integrin alpha4 antagonist

0.049 0.012 CHEMBL3544626

0.062 0.009 CHEMBL1741437

CHEMBL1741437
0.0090.2360.121-Alkyl-2-acetylglycerophosphocholine esterase inhibitor

0.094 0.004 CHEMBL3544622

0.12 0.004 CHEMBL3544790

0.043 0.013 CHEMBL3544600

0.07 0.005 CHEMBL3544626

0.053 0.008 CHEMBL1741437

CHEMBL3544790
0.010.2370.183Thromboxane A2 antagonist

0.12 0.005 CHEMBL3544790

0.129 0.005 CHEMBL3544623

0.148 0.004 CHEMBL3544625

0.183 0.003 CHEMBL3544626

0.142 0.004 CHEMBL1741437

CHEMBL3544626
0.0420.2720.17Caspase 3 inhibitor

0.16 0.022 CHEMBL3544790

0.119 0.061 CHEMBL3544623

0.123 0.056 CHEMBL3544625

0.17 0.017 CHEMBL3544626

0.116 0.066 CHEMBL1741437

CHEMBL3544626
0.0580.2880.147MAP3K9 inhibitor

0.132 0.091 CHEMBL3544720

0.147 0.064 CHEMBL3544599

0.137 0.081 CHEMBL3544624

CHEMBL3544599
0.0040.2360.044Squalene synthetase inhibitor

0.028 0.025 CHEMBL3544704

0.044 0.016 CHEMBL3544625

0.033 0.022 CHEMBL3544626

CHEMBL3544625
0.0060.2380.108Antimetabolite

0.055 0.029 CHEMBL3544790

0.048 0.033 CHEMBL3544623

0.043 0.038 CHEMBL3544625

0.108 0.015 CHEMBL3544626

0.064 0.024 CHEMBL1741437

CHEMBL3544626
0.0040.2380.087Prostaglandin EP2 agonist

0.049 0.006 CHEMBL3544790

0.087 0.003 CHEMBL3544623

0.05 0.005 CHEMBL3544625

0.057 0.005 CHEMBL3544626

0.035 0.01 CHEMBL1741437

CHEMBL3544623
0.0040.2390.094GP IIb/IIIa receptor antagonist

0.047 0.035 CHEMBL3544790

0.05 0.033 CHEMBL3544625

0.094 0.019 CHEMBL3544626

0.09 0.02 CHEMBL1741437

CHEMBL3544626
0.0160.2510.124AICAR transformylase inhibitor

0.059 0.015 CHEMBL3544790

0.052 0.02 CHEMBL3544623

0.046 0.027 CHEMBL3544625

0.124 0.004 CHEMBL3544626

0.065 0.012 CHEMBL1741437

CHEMBL3544626
0.0040.2420.042Uridine phosphorylase inhibitor

0.035 0.014 CHEMBL3544790

0.031 0.017 CHEMBL3544623

0.026 0.021 CHEMBL3544625

0.039 0.012 CHEMBL3544626

0.042 0.011 CHEMBL1741437

CHEMBL1741437
0.0050.2440.099Retinoid X receptor agonist

0.039 0.023 CHEMBL3544790

0.033 0.027 CHEMBL3544623

0.092 0.005 CHEMBL3544625

0.082 0.007 CHEMBL3544626

0.099 0.005 CHEMBL1741437

CHEMBL1741437
0.0390.2790.135Xanthine oxidase inhibitor

0.102 0.058 CHEMBL3544790

0.09 0.071 CHEMBL3544623

0.095 0.064 CHEMBL3544624

0.13 0.042 CHEMBL3544625

0.113 0.051 CHEMBL3544626

0.135 0.04 CHEMBL1741437

CHEMBL1741437
0.0760.3170.398Succinate dehydrogenase inhibitor

0.181 0.066 CHEMBL3544721

0.259 0.019 CHEMBL3544622

0.398 0.004 CHEMBL3544790

0.171 0.079 CHEMBL3544600

0.245 0.024 CHEMBL3544623

0.154 0.105 CHEMBL3544624

0.326 0.007 CHEMBL3544625

0.27 0.017 CHEMBL3544626

0.261 0.019 CHEMBL1741437

CHEMBL3544790
0.0020.2430.015Beta 3 adrenoreceptor agonist

0.015 0.005 CHEMBL3544623

0.013 0.007 CHEMBL1741437

CHEMBL3544623
0.0590.30.164Mannose-6-phosphate isomerase inhibitor

0.145 0.069 CHEMBL3544790

0.128 0.088 CHEMBL3544625

0.129 0.088 CHEMBL3544626

0.164 0.054 CHEMBL1741437

CHEMBL1741437
0.0120.2540.206Thromboxane antagonist

0.132 0.005 CHEMBL3544790

0.139 0.005 CHEMBL3544623

0.158 0.004 CHEMBL3544625

0.206 0.004 CHEMBL3544626

0.155 0.004 CHEMBL1741437

CHEMBL3544626
0.0410.2840.127Proteasome inhibitor

0.111 0.073 CHEMBL3544622

0.105 0.081 CHEMBL3544600

0.127 0.06 CHEMBL3544626

0.106 0.079 CHEMBL1741437

CHEMBL3544626
0.0060.2490.017Integrin beta6 antagonist

0.015 0.008 CHEMBL3544790

0.014 0.009 CHEMBL3544623

0.015 0.009 CHEMBL3544625

0.017 0.005 CHEMBL3544626

0.016 0.006 CHEMBL1741437

CHEMBL3544626
0.0070.250.051Lysophosphatidic acid 1 receptor antagonist

0.02 0.018 CHEMBL3544790

0.051 0.004 CHEMBL3544623

0.045 0.004 CHEMBL3544626

0.038 0.005 CHEMBL1741437

CHEMBL3544623
0.0890.3330.186Death-associated protein kinase 2 inhibitor

0.143 0.123 CHEMBL3544720

0.139 0.135 CHEMBL3544721

0.186 0.047 CHEMBL3544622

0.147 0.114 CHEMBL3544599

0.166 0.074 CHEMBL3544600

CHEMBL3544622
0.0080.2520.104Retinoid X alpha receptor agonist

0.041 0.019 CHEMBL3544790

0.031 0.029 CHEMBL3544623

0.077 0.008 CHEMBL3544625

0.074 0.008 CHEMBL3544626

0.104 0.005 CHEMBL1741437

CHEMBL1741437
0.0250.2710.136GABA aminotransferase inhibitor

0.084 0.041 CHEMBL3544622

0.136 0.011 CHEMBL3544790

0.081 0.046 CHEMBL3544623

0.109 0.021 CHEMBL3544625

0.108 0.022 CHEMBL3544626

0.087 0.039 CHEMBL1741437

CHEMBL3544790
0.0290.2750.066Telomerase inhibitor

0.066 0.057 CHEMBL1190855

CHEMBL1190855
0.0160.2620.074Matrix metalloproteinase inhibitor

0.074 0.041 CHEMBL3544600

0.066 0.047 CHEMBL3544626

CHEMBL3544600
0.0180.2640.0573(or 17)beta-hydroxysteroid dehydrogenase inhibitor

0.057 0.033 CHEMBL3544790

CHEMBL3544790
0.010.2570.041Angiotensin II receptor antagonist

0.041 0.013 CHEMBL3544626

0.039 0.016 CHEMBL1741437

CHEMBL3544626
0.0230.2710.075Metalloproteinase-9 inhibitor

0.075 0.048 CHEMBL3544626

0.069 0.058 CHEMBL1741437

CHEMBL3544626
0.0210.270.056Beta adrenoreceptor agonist

0.056 0.01 CHEMBL3544623

0.047 0.024 CHEMBL3544626

0.049 0.02 CHEMBL1741437

CHEMBL3544623
0.0480.2980.339Aldehyde dehydrogenase inhibitor

0.163 0.04 CHEMBL3544704

0.178 0.034 CHEMBL3544721

0.153 0.046 CHEMBL3544622

0.184 0.032 CHEMBL3559662

0.339 0.008 CHEMBL3544790

0.12 0.071 CHEMBL3544600

0.172 0.036 CHEMBL3544623

0.124 0.067 CHEMBL3544624

0.217 0.024 CHEMBL3544625

0.274 0.014 CHEMBL3544626

0.194 0.029 CHEMBL1741437

CHEMBL3544790
0.0220.2730.12Bombesin 1 receptor agonist

0.059 0.043 CHEMBL3544719

0.06 0.04 CHEMBL3544721

0.12 0.013 CHEMBL3544622

0.062 0.039 CHEMBL3544600

CHEMBL3544622
0.0250.2760.057CD45 antagonist

0.047 0.043 CHEMBL3544622

0.053 0.029 CHEMBL3544790

0.05 0.034 CHEMBL3544625

0.057 0.024 CHEMBL3544626

0.046 0.045 CHEMBL1741437

CHEMBL3544626
0.0380.290.309UDP-N-acetylglucosamine 1-carboxyvinyltransferase inhibitor

0.125 0.036 CHEMBL3544704

0.128 0.035 CHEMBL3544622

0.106 0.048 CHEMBL3559662

0.231 0.012 CHEMBL3544790

0.165 0.022 CHEMBL3544623

0.107 0.048 CHEMBL3544624

0.155 0.025 CHEMBL3544625

0.309 0.006 CHEMBL3544626

0.2 0.016 CHEMBL1741437

CHEMBL3544626
0.0130.2660.036Melatonin receptor 1A agonist

0.031 0.03 CHEMBL3544721

0.036 0.019 CHEMBL3544600

CHEMBL3544600
0.0050.2580.077Factor XI inhibitor

0.058 0.007 CHEMBL3544719

0.077 0.005 CHEMBL3544793

CHEMBL3544793
0.0020.2560.056Prostaglandin EP4 agonist

0.056 0.005 CHEMBL3544623

0.013 0.011 CHEMBL3544625

0.026 0.008 CHEMBL3544626

0.015 0.01 CHEMBL1741437

CHEMBL3544623
0.0060.2620.038Nicotinic acid receptor 2 antagonist

0.029 0.015 CHEMBL3544625

0.038 0.005 CHEMBL3544626

0.036 0.007 CHEMBL1741437

CHEMBL3544626
0.0080.2640.053Angiotensin AT1 receptor antagonist

0.053 0.013 CHEMBL3544626

0.052 0.015 CHEMBL1741437

CHEMBL3544626
0.0220.2780.124NMDA receptor agonist

0.076 0.032 CHEMBL3544790

0.069 0.037 CHEMBL3544623

0.124 0.012 CHEMBL3544625

0.107 0.017 CHEMBL3544626

0.113 0.015 CHEMBL1741437

CHEMBL3544625
0.0260.2830.132HIV-1 integrase inhibitor

0.063 0.062 CHEMBL3544721

0.066 0.054 CHEMBL3544622

0.067 0.052 CHEMBL3544621

0.132 0.012 CHEMBL3544790

0.066 0.054 CHEMBL3544600

0.082 0.037 CHEMBL3544625

0.08 0.038 CHEMBL1741437

CHEMBL3544790
0.0090.2690.05Potassium channel Kv1.3 blocker

0.05 0.03 CHEMBL3544624

CHEMBL3544624
0.1110.3730.56Antibacterial

0.443 0.059 CHEMBL3544704

0.244 0.182 CHEMBL3544719

0.236 0.191 CHEMBL3544622

0.231 0.195 CHEMBL3544791

0.496 0.042 CHEMBL3559662

0.248 0.179 CHEMBL3544793

0.215 0.212 CHEMBL3544621

0.235 0.192 CHEMBL3544790

0.56 0.026 CHEMBL3544598

0.282 0.149 CHEMBL3544623

0.405 0.075 CHEMBL3544624

0.347 0.104 CHEMBL3544625

0.233 0.193 CHEMBL3544626

0.214 0.213 CHEMBL1741437

CHEMBL3544598
0.0240.2860.088Purinergic P2X1 antagonist

0.074 0.028 CHEMBL3544790

0.073 0.029 CHEMBL3544623

0.063 0.039 CHEMBL3544625

0.088 0.021 CHEMBL3544626

0.08 0.025 CHEMBL1741437

CHEMBL3544626
0.0420.3040.286Interleukin 1b antagonist

0.119 0.063 CHEMBL3544622

0.118 0.064 CHEMBL3544790

0.286 0.009 CHEMBL3544623

0.226 0.015 CHEMBL3544625

0.116 0.066 CHEMBL3544626

0.158 0.035 CHEMBL1741437

CHEMBL3544623
0.0280.2920.065Beta 2 adrenoreceptor agonist

0.065 0.032 CHEMBL3544623

CHEMBL3544623
0.0450.3090.259Electron transport complex I inhibitor

0.259 0.005 CHEMBL3544623

0.117 0.052 CHEMBL3544624

CHEMBL3544623
0.0150.2790.039Phenylethanolamine N methyltransferase inhibitor

0.039 0.031 CHEMBL6200

CHEMBL6200
0.0040.270.07Vitronectin receptor antagonist

0.059 0.005 CHEMBL3544626

0.07 0.005 CHEMBL1741437

CHEMBL1741437
0.0660.3320.25Melanin inhibitor

0.132 0.111 CHEMBL3544622

0.19 0.045 CHEMBL3544790

0.159 0.07 CHEMBL3544623

0.203 0.04 CHEMBL3544624

0.25 0.029 CHEMBL3544625

0.179 0.052 CHEMBL3544626

0.145 0.089 CHEMBL1741437

CHEMBL3544625
0.0080.2740.054Carbonic anhydrase VB inhibitor

0.054 0.04 CHEMBL3544626

CHEMBL3544626
0.0380.3050.162Lipid peroxidase inhibitor

0.162 0.06 CHEMBL3544598

0.131 0.083 CHEMBL3544626

CHEMBL3544598
0.0140.2820.105Protein 50S ribosomal subunit inhibitor

0.072 0.023 CHEMBL3544704

0.067 0.026 CHEMBL3559662

0.105 0.012 CHEMBL3544598

0.086 0.017 CHEMBL3544624

CHEMBL3544598
0.0210.290.099Sphingosine 1-phosphate receptor 1 antagonist

0.059 0.031 CHEMBL3544790

0.078 0.015 CHEMBL3544623

0.099 0.009 CHEMBL3544626

0.056 0.037 CHEMBL1741437

CHEMBL3544626
0.0050.2770.053Histone deacetylase 1 inhibitor

0.023 0.018 CHEMBL3544721

0.034 0.014 CHEMBL3544622

0.053 0.011 CHEMBL3544600

0.024 0.017 CHEMBL3544625

CHEMBL3544600
0.0090.2820.133Factor XIa inhibitor

0.056 0.014 CHEMBL3544719

0.133 0.004 CHEMBL3544793

CHEMBL3544793
0.0050.2790.164Integrin antagonist

0.038 0.032 CHEMBL3544790

0.051 0.027 CHEMBL3544623

0.077 0.02 CHEMBL3544625

0.159 0.009 CHEMBL3544626

0.164 0.009 CHEMBL1741437

CHEMBL1741437
0.0670.3420.162Vanilloid 1 agonist

0.13 0.065 CHEMBL3544721

0.132 0.063 CHEMBL3544622

0.138 0.053 CHEMBL3544790

0.13 0.066 CHEMBL3544600

0.134 0.06 CHEMBL3544625

0.162 0.028 CHEMBL3544626

0.14 0.05 CHEMBL1741437

CHEMBL3544626
0.0240.3020.278Alcohol dehydrogenase inhibitor

0.109 0.044 CHEMBL3544622

0.154 0.019 CHEMBL3544790

0.122 0.033 CHEMBL3544623

0.126 0.031 CHEMBL3544625

0.278 0.006 CHEMBL3544626

0.17 0.016 CHEMBL1741437

CHEMBL3544626
0.0640.3430.38Non-steroidal antiinflammatory agent

0.138 0.134 CHEMBL3544721

0.272 0.035 CHEMBL3544790

0.327 0.023 CHEMBL3544623

0.171 0.094 CHEMBL3544624

0.218 0.058 CHEMBL3544625

0.301 0.028 CHEMBL3544626

0.38 0.016 CHEMBL1741437

CHEMBL1741437
0.0060.2860.047Integrin alphaVbeta1 antagonist

0.018 0.016 CHEMBL3544790

0.047 0.005 CHEMBL3544626

0.039 0.005 CHEMBL1741437

CHEMBL3544626
0.0040.2850.024Integrin beta3 antagonist

0.024 0.011 CHEMBL3544626

0.023 0.012 CHEMBL1741437

CHEMBL3544626
0.0230.3040.057Carbonic anhydrase II stimulant

0.057 0.027 CHEMBL3544626

0.051 0.037 CHEMBL1741437

CHEMBL3544626
0.0020.2840.073G-protein-coupled receptor 120 agonist

0.024 0.007 CHEMBL3544790

0.018 0.011 CHEMBL3544623

0.073 0.003 CHEMBL3544626

0.026 0.006 CHEMBL1741437

CHEMBL3544626
0.0090.2940.041Carbonic anhydrase I stimulant

0.041 0.022 CHEMBL3544626

0.041 0.023 CHEMBL1741437

CHEMBL1741437
0.0260.3110.177Ornithine decarboxylase inhibitor

0.094 0.051 CHEMBL3544721

0.117 0.028 CHEMBL3544790

0.177 0.006 CHEMBL3544623

0.131 0.019 CHEMBL3544625

0.147 0.012 CHEMBL3544626

0.109 0.035 CHEMBL1741437

CHEMBL3544623
0.0260.3120.094Myeloperoxidase inhibitor

0.083 0.062 CHEMBL3544721

0.094 0.043 CHEMBL3544622

0.081 0.065 CHEMBL3544626

CHEMBL3544622
0.0050.2930.025Histone deacetylase class IIb inhibitor

0.025 0.018 CHEMBL3544600

CHEMBL3544600
0.010.2990.07Xanthine dehydrogenase inhibitor

0.064 0.035 CHEMBL3544790

0.07 0.031 CHEMBL3544625

0.057 0.04 CHEMBL3544626

0.064 0.035 CHEMBL1741437

CHEMBL3544625
0.0330.3240.124Alkaline phosphatase inhibitor

0.124 0.081 CHEMBL1741437

CHEMBL1741437
0.0240.3180.132Ca(v)2.2 blocker

0.132 0.035 CHEMBL3544624

CHEMBL3544624
0.0310.3260.113Dual specificity tyrosine-phosphorylation-regulated kinase 4 inhibitor

0.113 0.107 CHEMBL3544719

CHEMBL3544719
0.010.3070.072NMDA receptor glycine site agonist

0.056 0.051 CHEMBL3544625

0.072 0.035 CHEMBL1741437

CHEMBL1741437
0.0790.3770.271Transcription factor STAT3 inhibitor

0.271 0.069 CHEMBL3544622

0.183 0.159 CHEMBL3544600

0.21 0.121 CHEMBL3544624

0.174 0.173 CHEMBL3544625

CHEMBL3544622
0.0110.310.079Liver X receptor alpha agonist

0.041 0.028 CHEMBL3544626

0.079 0.007 CHEMBL1741437

CHEMBL1741437
0.0090.310.082Neutrophil collagenase inhibitor

0.061 0.049 CHEMBL3544790

0.068 0.041 CHEMBL3544600

0.082 0.031 CHEMBL3544626

0.064 0.046 CHEMBL1741437

CHEMBL3544626
0.0130.3140.091Diacylglycerol O-acyltransferase inhibitor

0.065 0.023 CHEMBL3544626

0.091 0.01 CHEMBL1741437

CHEMBL1741437
0.0370.3380.165Aryl hydrocarbon receptor agonist

0.165 0.124 CHEMBL1741437

CHEMBL1741437
0.080.3810.323Transcription factor STAT inhibitor

0.323 0.044 CHEMBL3544622

0.204 0.133 CHEMBL3544600

0.226 0.106 CHEMBL3544624

0.22 0.112 CHEMBL3544625

0.18 0.168 CHEMBL3544626

CHEMBL3544622
0.0110.3150.052Glutamate (mGluR3) agonist

0.052 0.004 CHEMBL3544790

0.03 0.028 CHEMBL3544623

0.036 0.015 CHEMBL3544626

0.032 0.022 CHEMBL1741437

CHEMBL3544790
0.0210.3260.052Dihydroorotate oxidase inhibitor

0.052 0.045 CHEMBL1741437

CHEMBL1741437
0.0080.3150.071Thymidylate synthase inhibitor

0.056 0.02 CHEMBL3544790

0.047 0.032 CHEMBL3544623

0.071 0.011 CHEMBL3544626

0.062 0.016 CHEMBL1741437

CHEMBL3544626
0.0190.3290.063Elastase 1 inhibitor

0.063 0.057 CHEMBL3544626

CHEMBL3544626
0.0060.3160.045AMPA 2 receptor antagonist

0.045 0.012 CHEMBL1741437

CHEMBL1741437
0.0110.3210.316Phosphodiesterase 4D inhibitor

0.316 0.005 CHEMBL3544793

0.166 0.016 CHEMBL1741437

CHEMBL3544793
0.0290.3420.077Caspase 9 inhibitor

0.074 0.028 CHEMBL3544790

0.068 0.035 CHEMBL3544623

0.073 0.029 CHEMBL3544625

0.077 0.025 CHEMBL3544626

0.06 0.046 CHEMBL1741437

CHEMBL3544626
0.0050.3180.024Histone deacetylase 6 inhibitor

0.024 0.019 CHEMBL3544600

CHEMBL3544600
0.0220.3380.107Macrophage migration inhibitory factor inhibitor

0.098 0.036 CHEMBL3544790

0.069 0.068 CHEMBL3544625

0.107 0.031 CHEMBL3544626

0.081 0.049 CHEMBL1741437

CHEMBL3544626
0.0180.3340.072Heparanase inhibitor

0.053 0.037 CHEMBL3544790

0.072 0.01 CHEMBL3544598

0.058 0.026 CHEMBL3544625

0.058 0.026 CHEMBL3544626

0.071 0.011 CHEMBL1741437

CHEMBL3544598
0.0050.3210.059Liver X receptor beta agonist

0.059 0.008 CHEMBL1741437

CHEMBL1741437
0.0420.3640.184Cyclooxygenase 3 inhibitor

0.103 0.099 CHEMBL3544790

0.154 0.045 CHEMBL3544598

0.136 0.061 CHEMBL3544623

0.12 0.077 CHEMBL3544626

0.184 0.025 CHEMBL1741437

CHEMBL1741437
0.0170.340.079Metalloproteinase-2 inhibitor

0.07 0.065 CHEMBL3544790

0.074 0.06 CHEMBL3544600

0.079 0.053 CHEMBL3544626

CHEMBL3544626
0.0290.3520.193Chelator

0.168 0.03 CHEMBL3544721

0.107 0.067 CHEMBL3544622

0.179 0.028 CHEMBL3544790

0.193 0.026 CHEMBL3544600

0.128 0.047 CHEMBL3544625

0.159 0.033 CHEMBL3544626

0.135 0.042 CHEMBL1741437

CHEMBL3544600
0.0070.3340.033Plasmepsin I inhibitor

0.033 0.018 CHEMBL3544624

CHEMBL3544624
0.0150.3430.079Carbonic anhydrase VA inhibitor

0.06 0.059 CHEMBL3544625

0.062 0.057 CHEMBL3544626

0.079 0.038 CHEMBL1741437

CHEMBL1741437
0.0650.3930.234Phospholipase C inhibitor

0.182 0.059 CHEMBL3544790

0.162 0.084 CHEMBL3544623

0.187 0.054 CHEMBL3544625

0.234 0.029 CHEMBL3544626

0.178 0.063 CHEMBL1741437

CHEMBL3544626
0.0280.3580.108Glutathione S-transferase inhibitor

0.094 0.044 CHEMBL3544622

0.108 0.031 CHEMBL3544790

0.077 0.066 CHEMBL3544600

0.077 0.066 CHEMBL3544623

0.094 0.043 CHEMBL3544625

0.104 0.034 CHEMBL3544626

0.101 0.036 CHEMBL1741437

CHEMBL3544790
0.0310.3620.135GABA B receptor agonist

0.088 0.029 CHEMBL3544622

0.125 0.006 CHEMBL3544790

0.11 0.011 CHEMBL3544623

0.08 0.041 CHEMBL3544625

0.135 0.005 CHEMBL3544626

0.113 0.01 CHEMBL1741437

CHEMBL3544626
0.0110.3430.09Mineralocorticoid receptor antagonist

0.09 0.009 CHEMBL3544624

CHEMBL3544624
0.0090.3420.071Dihydrofolate reductase inhibitor

0.042 0.035 CHEMBL3544790

0.046 0.024 CHEMBL3544625

0.071 0.006 CHEMBL3544626

0.046 0.025 CHEMBL1741437

CHEMBL3544626
0.0340.3670.28Bone formation stimulant

0.105 0.101 CHEMBL3544791

0.172 0.045 CHEMBL3544790

0.228 0.029 CHEMBL3544623

0.227 0.029 CHEMBL3544625

0.28 0.02 CHEMBL3544626

0.209 0.033 CHEMBL1741437

CHEMBL3544626
0.0020.3370.096Prostaglandin E2 agonist

0.032 0.01 CHEMBL3544790

0.096 0.004 CHEMBL3544623

0.044 0.007 CHEMBL3544625

0.046 0.006 CHEMBL3544626

0.034 0.009 CHEMBL1741437

CHEMBL3544623
0.0120.3470.049Elastase inhibitor

0.049 0.043 CHEMBL3544621

CHEMBL3544621
0.0990.4340.221Caspase 3 stimulant

0.215 0.149 CHEMBL3544704

0.221 0.141 CHEMBL3544790

0.211 0.153 CHEMBL3544624

0.206 0.161 CHEMBL3544626

CHEMBL3544790
0.0250.360.119Sphingosine 1-phosphate receptor antagonist

0.085 0.036 CHEMBL3544790

0.093 0.027 CHEMBL3544623

0.119 0.013 CHEMBL3544626

0.08 0.045 CHEMBL1741437

CHEMBL3544626
0.0280.3690.062Gonadotropin-releasing hormone receptor agonist

0.062 0.036 CHEMBL3544622

CHEMBL3544622
0.0050.350.065Protease activated receptor 1 antagonist

0.065 0.025 CHEMBL3544622

CHEMBL3544622
0.0060.3520.056ATP citrate lysase inhibitor

0.029 0.026 CHEMBL3544790

0.037 0.015 CHEMBL3544625

0.056 0.006 CHEMBL3544626

0.033 0.021 CHEMBL1741437

CHEMBL3544626
0.0040.3490.128Prostaglandin agonist

0.045 0.012 CHEMBL3544790

0.128 0.004 CHEMBL3544623

0.099 0.005 CHEMBL3544625

0.072 0.007 CHEMBL3544626

0.046 0.011 CHEMBL1741437

CHEMBL3544623
0.0050.3510.057Histone deacetylase class IIa inhibitor

0.038 0.018 CHEMBL3544721

0.049 0.014 CHEMBL3544622

0.057 0.013 CHEMBL3544600

0.034 0.02 CHEMBL3544625

CHEMBL3544600
0.0050.3520.056Dihydropteroate synthase inhibitor

0.056 0.013 CHEMBL3544626

CHEMBL3544626
0.0180.3720.117Transcription factor AP-1 inhibitor

0.065 0.037 CHEMBL3544790

0.117 0.01 CHEMBL3544625

0.061 0.043 CHEMBL3544626

CHEMBL3544625
0.0060.3610.042Catechol O-methyltransferase inhibitor

0.042 0.012 CHEMBL3544790

CHEMBL3544790
0.0120.3680.069Carbonic anhydrase V inhibitor

0.069 0.043 CHEMBL1741437

CHEMBL1741437
0.0250.3820.085Carbonic anhydrase VI inhibitor

0.083 0.054 CHEMBL3544623

0.085 0.052 CHEMBL3544625

0.078 0.06 CHEMBL3544626

CHEMBL3544625
0.0160.3740.049Guanylate cyclase stimulant

0.04 0.039 CHEMBL3544625

0.049 0.022 CHEMBL3544626

CHEMBL3544626
0.0050.3670.037Histone deacetylase class II inhibitor

0.026 0.023 CHEMBL3544721

0.033 0.016 CHEMBL3544622

0.037 0.014 CHEMBL3544600

0.028 0.02 CHEMBL3544625

CHEMBL3544600
0.0660.4320.451Hypoglycemic

0.309 0.05 CHEMBL3544704

0.364 0.035 CHEMBL3544790

0.451 0.02 CHEMBL3544598

0.438 0.022 CHEMBL3544623

0.231 0.088 CHEMBL3544625

0.36 0.036 CHEMBL3544626

0.339 0.04 CHEMBL1741437

CHEMBL3544598
0.0340.4010.59Angiogenesis stimulant

0.351 0.032 CHEMBL3544704

0.297 0.05 CHEMBL3544622

0.206 0.092 CHEMBL3559662

0.287 0.054 CHEMBL3544790

0.59 0.007 CHEMBL3544598

0.231 0.079 CHEMBL3544623

0.296 0.051 CHEMBL3544625

0.305 0.047 CHEMBL3544626

0.155 0.119 CHEMBL1741437

CHEMBL3544598
0.0580.4240.22512-Lipoxygenase inhibitor

0.183 0.17 CHEMBL3544790

0.199 0.153 CHEMBL3544625

0.225 0.126 CHEMBL3544626

0.189 0.164 CHEMBL1741437

CHEMBL3544626
0.0560.430.397Growth hormone agonist

0.191 0.062 CHEMBL3544622

0.23 0.049 CHEMBL3544790

0.212 0.054 CHEMBL3544623

0.15 0.087 CHEMBL3544625

0.397 0.016 CHEMBL3544626

CHEMBL3544626
0.0420.4180.409Antimitotic

0.187 0.092 CHEMBL3544621

0.409 0.022 CHEMBL3544624

CHEMBL3544624
0.0090.3860.105Leukotriene B4 antagonist

0.068 0.021 CHEMBL3544790

0.105 0.009 CHEMBL3544623

0.069 0.02 CHEMBL3544625

0.083 0.014 CHEMBL3544626

0.06 0.027 CHEMBL1741437

CHEMBL3544623
0.010.3880.179Monophenol monooxygenase inhibitor

0.125 0.059 CHEMBL3544790

0.122 0.06 CHEMBL3544623

0.125 0.058 CHEMBL3544624

0.164 0.042 CHEMBL3544625

0.179 0.038 CHEMBL3544626

0.123 0.06 CHEMBL1741437

CHEMBL3544626
0.0230.4020.229Cell adhesion molecule inhibitor

0.143 0.017 CHEMBL3544790

0.082 0.05 CHEMBL3544598

0.114 0.026 CHEMBL3544623

0.18 0.011 CHEMBL3544625

0.229 0.008 CHEMBL3544626

0.225 0.008 CHEMBL1741437

CHEMBL3544626
0.0520.4310.267Alpha-glucosidase inhibitor

0.267 0.177 CHEMBL3544598

CHEMBL3544598
0.0190.3980.097Urease inhibitor

0.097 0.07 CHEMBL3544622

0.087 0.082 CHEMBL3544623

CHEMBL3544622
0.0260.4070.102Beta glucuronidase inhibitor

0.093 0.082 CHEMBL3544598

0.102 0.067 CHEMBL3544624

CHEMBL3544624
0.0110.3940.136H+/K+-transporting ATPase inhibitor

0.136 0.005 CHEMBL3544721

0.098 0.009 CHEMBL3544622

0.094 0.01 CHEMBL3544790

0.121 0.007 CHEMBL3544600

CHEMBL3544721
0.0130.4090.028Thiazolidinedione

0.028 0.026 CHEMBL3544626

CHEMBL3544626
0.0650.4610.228Lipocortins synthesis antagonist

0.189 0.064 CHEMBL3544719

0.135 0.13 CHEMBL578211

0.146 0.111 CHEMBL3544791

0.175 0.076 CHEMBL3559662

0.161 0.091 CHEMBL3544599

0.155 0.098 CHEMBL1614639

0.228 0.041 CHEMBL3544790

0.191 0.062 CHEMBL3544623

0.145 0.113 CHEMBL3544625

0.217 0.047 CHEMBL3544626

0.167 0.084 CHEMBL1741437

CHEMBL3544790
0.0050.4050.076Histone deacetylase 5 inhibitor

0.047 0.017 CHEMBL3544721

0.068 0.013 CHEMBL3544622

0.032 0.024 CHEMBL3544790

0.076 0.012 CHEMBL3544600

0.044 0.018 CHEMBL3544625

CHEMBL3544600
0.0160.4160.085Carbonic anhydrase XIII inhibitor

0.066 0.062 CHEMBL3544790

0.085 0.047 CHEMBL3544623

0.065 0.063 CHEMBL3544624

0.068 0.06 CHEMBL3544625

0.076 0.053 CHEMBL3544626

CHEMBL3544623
0.0380.4410.281Calpain inhibitor

0.215 0.099 CHEMBL3544721

0.281 0.041 CHEMBL3544622

0.186 0.128 CHEMBL3544790

0.273 0.046 CHEMBL3544600

0.2 0.114 CHEMBL3544626

0.18 0.134 CHEMBL1741437

CHEMBL3544622
0.0040.4080.048Prostaglandin EP4 antagonist

0.048 0.009 CHEMBL3544623

0.037 0.012 CHEMBL3544625

0.048 0.009 CHEMBL3544626

0.03 0.015 CHEMBL1741437

CHEMBL3544626
0.0070.4120.0823-Oxoacyl-[acyl-carrier-protein] synthase inhibitor

0.066 0.033 CHEMBL3544790

0.066 0.034 CHEMBL3544625

0.082 0.024 CHEMBL3544626

CHEMBL3544626
0.1170.5230.515Calcium channel L-type activator

0.279 0.175 CHEMBL6200

0.449 0.051 CHEMBL3544719

0.393 0.086 CHEMBL578211

0.515 0.022 CHEMBL3544721

0.39 0.088 CHEMBL3544791

0.364 0.107 CHEMBL3544793

0.408 0.076 CHEMBL3544599

0.39 0.088 CHEMBL3544621

0.305 0.153 CHEMBL3544600

0.438 0.057 CHEMBL3544623

0.292 0.164 CHEMBL3544626

0.253 0.202 CHEMBL1741437

CHEMBL3544721
0.020.4270.087Leukotriene C antagonist

0.065 0.02 CHEMBL3544790

0.071 0.013 CHEMBL3544623

0.065 0.02 CHEMBL3544625

0.087 0.005 CHEMBL3544626

0.074 0.011 CHEMBL1741437

CHEMBL3544626
0.0050.4130.516Raf kinase C inhibitor

0.495 0.004 CHEMBL3544720

0.516 0.004 CHEMBL3544599

CHEMBL3544599
0.0580.4670.149Sphingosine 1-phosphate receptor 2 agonist

0.11 0.074 CHEMBL578211

0.149 0.026 CHEMBL3544791

CHEMBL3544791
0.0490.4590.194Thyroid hormone beta antagonist

0.194 0.16 CHEMBL1741437

CHEMBL1741437
0.0310.4410.125Toll-Like receptor 4 antagonist

0.125 0.039 CHEMBL3544598

0.097 0.075 CHEMBL3544625

0.098 0.073 CHEMBL3544626

CHEMBL3544598
0.0290.4390.208Amylase inhibitor

0.174 0.054 CHEMBL3544790

0.11 0.088 CHEMBL3544598

0.118 0.082 CHEMBL3544623

0.208 0.042 CHEMBL3544624

0.148 0.065 CHEMBL3544625

0.12 0.081 CHEMBL3544626

0.159 0.06 CHEMBL1741437

CHEMBL3544624
0.0150.4270.131Prostaglandin F2 alpha antagonist

0.096 0.013 CHEMBL3544790

0.095 0.013 CHEMBL3544623

0.092 0.015 CHEMBL3544625

0.131 0.005 CHEMBL3544626

0.082 0.021 CHEMBL1741437

CHEMBL3544626
0.0180.4320.11Potassium channel (Ca-activated) activator

0.11 0.048 CHEMBL1741437

CHEMBL1741437
0.0070.4230.028Caspase 6 inhibitor

0.028 0.027 CHEMBL3544626

CHEMBL3544626
0.0130.4290.061Leukotriene C4 antagonist

0.042 0.02 CHEMBL3544790

0.047 0.013 CHEMBL3544623

0.042 0.02 CHEMBL3544625

0.061 0.005 CHEMBL3544626

0.049 0.011 CHEMBL1741437

CHEMBL3544626
0.0480.4640.367Hepatoprotectant

0.242 0.046 CHEMBL3544704

0.136 0.126 CHEMBL3544790

0.367 0.017 CHEMBL3544598

0.133 0.13 CHEMBL3544623

0.172 0.088 CHEMBL3544625

0.163 0.097 CHEMBL3544626

0.136 0.126 CHEMBL1741437

CHEMBL3544598
0.0480.4670.216Calpain 2 inhibitor

0.216 0.174 CHEMBL3544600

CHEMBL3544600
0.0470.4670.222Thyroid hormone antagonist

0.222 0.143 CHEMBL1741437

CHEMBL1741437
0.0160.4370.244Topoisomerase I inhibitor

0.244 0.018 CHEMBL3544704

0.201 0.026 CHEMBL3559662

0.114 0.059 CHEMBL3544621

0.178 0.032 CHEMBL3544598

0.09 0.079 CHEMBL3544624

CHEMBL3544704
0.0130.4370.089Carnitine palmitoyltransferase 1B inhibitor

0.089 0.005 CHEMBL1741437

CHEMBL1741437
0.0090.4350.043Kallikrein inhibitor

0.043 0.038 CHEMBL3544793

CHEMBL3544793
0.0260.4540.12Thioredoxin inhibitor

0.106 0.042 CHEMBL3544790

0.103 0.045 CHEMBL3544625

0.12 0.031 CHEMBL3544626

CHEMBL3544626
0.0520.4840.213Angiogenesis inhibitor

0.213 0.155 CHEMBL1614639

CHEMBL1614639
0.0030.4380.026Purinergic P2T antagonist

0.026 0.013 CHEMBL3544790

CHEMBL3544790
0.0040.4410.029Histone deacetylase 3 inhibitor

0.023 0.017 CHEMBL3544622

0.029 0.014 CHEMBL3544600

0.02 0.019 CHEMBL3544625

CHEMBL3544600
0.0050.4460.03Thyroid hormone agonist

0.029 0.014 CHEMBL3544626

0.03 0.012 CHEMBL1741437

CHEMBL1741437
0.0060.450.065Prostaglandin-E synthase inhibitor

0.065 0.055 CHEMBL3544790

0.064 0.057 CHEMBL1741437

CHEMBL3544790
0.0690.5130.405Sodium/bile acid cotransporter inhibitor

0.245 0.133 CHEMBL3544721

0.281 0.097 CHEMBL3544622

0.227 0.154 CHEMBL1614639

0.389 0.02 CHEMBL3544790

0.37 0.028 CHEMBL3544600

0.374 0.027 CHEMBL3544623

0.318 0.064 CHEMBL3544625

0.394 0.019 CHEMBL3544626

0.405 0.015 CHEMBL1741437

CHEMBL1741437
0.0290.4740.327Insulin sensitizer

0.16 0.12 CHEMBL3544622

0.254 0.032 CHEMBL3544790

0.179 0.097 CHEMBL3544600

0.284 0.02 CHEMBL3544623

0.294 0.017 CHEMBL3544625

0.327 0.011 CHEMBL3544626

0.312 0.014 CHEMBL1741437

CHEMBL3544626
0.0440.4920.209Folate antagonist

0.092 0.083 CHEMBL3544721

0.173 0.015 CHEMBL3544790

0.159 0.019 CHEMBL3544623

0.126 0.034 CHEMBL3544625

0.209 0.009 CHEMBL3544626

0.112 0.047 CHEMBL1741437

CHEMBL3544626
0.0370.4860.183Histone deacetylase SIRT1 inhibitor

0.121 0.089 CHEMBL3544719

0.183 0.038 CHEMBL3544721

0.177 0.042 CHEMBL3544622

0.147 0.064 CHEMBL3544600

0.143 0.068 CHEMBL3544624

0.153 0.059 CHEMBL3544626

0.112 0.101 CHEMBL1741437

CHEMBL3544721
0.0040.4550.0321,3-Beta-glucan synthase inhibitor

0.028 0.02 CHEMBL1614639

0.032 0.011 CHEMBL3544598

CHEMBL3544598
0.0310.4820.607Platelet antagonist

0.204 0.098 CHEMBL3544704

0.151 0.144 CHEMBL3544721

0.21 0.094 CHEMBL3544622

0.186 0.112 CHEMBL1614639

0.534 0.011 CHEMBL3544790

0.29 0.056 CHEMBL3544598

0.538 0.01 CHEMBL3544623

0.432 0.022 CHEMBL3544624

0.604 0.007 CHEMBL3544625

0.607 0.006 CHEMBL3544626

0.519 0.012 CHEMBL1741437

CHEMBL3544626
0.0150.4660.103Peroxisome proliferator-activated receptor gamma antagonist

0.075 0.042 CHEMBL3544790

0.094 0.019 CHEMBL3544623

0.098 0.017 CHEMBL3544626

0.103 0.014 CHEMBL1741437

CHEMBL1741437
0.0040.4550.016Calcium-sensing receptor antagonist

0.016 0.01 CHEMBL3544623

CHEMBL3544623
0.0360.4930.189Thioredoxin glutathione reductase inhibitor

0.188 0.183 CHEMBL3544790

0.189 0.182 CHEMBL3544600

CHEMBL3544600
0.0010.460.05Peroxisome proliferator-activated receptor alpha antagonist

0.04 0.009 CHEMBL3544626

0.05 0.008 CHEMBL1741437

CHEMBL1741437
0.0030.4630.043Peroxisome proliferator-activated receptor delta agonist

0.036 0.021 CHEMBL3544790

0.04 0.017 CHEMBL3544626

0.043 0.015 CHEMBL1741437

CHEMBL1741437
0.0380.4980.417Lipoxygenase inhibitor

0.325 0.059 CHEMBL3544790

0.266 0.089 CHEMBL3544623

0.234 0.111 CHEMBL3544624

0.417 0.033 CHEMBL3544625

0.299 0.072 CHEMBL3544626

0.245 0.103 CHEMBL1741437

CHEMBL3544625
0.0030.4660.044Retinoid X gamma receptor agonist

0.028 0.012 CHEMBL3544625

0.024 0.014 CHEMBL3544626

0.044 0.006 CHEMBL1741437

CHEMBL1741437
0.0020.4650.018KiSS-1 receptor antagonist

0.018 0.011 CHEMBL3544721

CHEMBL3544721
0.0050.4780.157Leukotriene antagonist

0.104 0.02 CHEMBL3544790

0.157 0.009 CHEMBL3544623

0.145 0.011 CHEMBL3544625

0.129 0.014 CHEMBL3544626

0.09 0.026 CHEMBL1741437

CHEMBL3544623
0.0050.4850.156Antineoplastic antibiotic

0.069 0.066 CHEMBL3544704

0.086 0.053 CHEMBL3559662

0.156 0.03 CHEMBL3544598

0.105 0.044 CHEMBL3544624

CHEMBL3544598
0.0050.4890.036Melatonin 2 agonist

0.036 0.02 CHEMBL3544600

CHEMBL3544600
0.0170.5020.093Estrogen receptor beta antagonist

0.093 0.078 CHEMBL3544720

CHEMBL3544720
0.0040.4950.022Adenosine A3 receptor agonist

0.022 0.008 CHEMBL3544704

0.022 0.008 CHEMBL3559662

CHEMBL3559662
0.0050.4970.059Liver X receptor alpha antagonist

0.027 0.025 CHEMBL3544623

0.028 0.021 CHEMBL3544626

0.059 0.005 CHEMBL1741437

CHEMBL1741437
0.0040.5010.07Purinergic P2Y12 antagonist

0.07 0.005 CHEMBL3544790

CHEMBL3544790
0.0340.5330.0783C-Like protease (SARS coronavirus) inhibitor

0.078 0.075 CHEMBL3544622

CHEMBL3544622
0.0030.5140.038Retinoid X beta receptor agonist

0.022 0.013 CHEMBL3544625

0.02 0.016 CHEMBL3544626

0.038 0.006 CHEMBL1741437

CHEMBL1741437
0.0040.5150.032Retinoid X gamma receptor antagonist

0.032 0.01 CHEMBL3544625

0.026 0.02 CHEMBL3544626

0.026 0.023 CHEMBL1741437

CHEMBL3544625
0.0240.540.588Interleukin antagonist

0.476 0.022 CHEMBL3544622

0.25 0.061 CHEMBL3544790

0.588 0.013 CHEMBL3544623

0.195 0.087 CHEMBL3544624

0.366 0.036 CHEMBL3544625

0.329 0.042 CHEMBL3544626

0.334 0.041 CHEMBL1741437

CHEMBL3544623
0.0090.5270.118Sphingosine 1-phosphate receptor 5 agonist

0.101 0.008 CHEMBL3544790

0.064 0.02 CHEMBL3544623

0.068 0.018 CHEMBL3544625

0.118 0.006 CHEMBL3544626

0.08 0.013 CHEMBL1741437

CHEMBL3544626
0.0260.5460.059Lipocortins synthesis agonist

0.059 0.039 CHEMBL3544790

0.058 0.039 CHEMBL3544598

0.054 0.053 CHEMBL3544623

CHEMBL3544790
0.0240.550.08Thioredoxin reductase inhibitor

0.08 0.063 CHEMBL3544625

CHEMBL3544625
0.0150.5420.062Factor IXa inhibitor

0.062 0.025 CHEMBL3544793

0.061 0.026 CHEMBL3544598

CHEMBL3544793
0.0030.5360.084Peroxisome proliferator-activated receptor alpha agonist

0.041 0.04 CHEMBL3544790

0.052 0.031 CHEMBL3544623

0.046 0.036 CHEMBL3544625

0.084 0.016 CHEMBL3544626

0.079 0.018 CHEMBL1741437

CHEMBL3544626
0.0060.5440.091Histone deacetylase SIRT2 inhibitor

0.091 0.037 CHEMBL3544622

CHEMBL3544622
0.0050.5430.033Melatonin agonist

0.033 0.023 CHEMBL3544600

CHEMBL3544600
0.0050.5440.049NMDA 2D receptor antagonist

0.049 0.008 CHEMBL3544625

CHEMBL3544625
0.0050.5450.06Protease activated receptor antagonist

0.06 0.048 CHEMBL3544622

CHEMBL3544622
0.0050.5460.082Glucagon-like peptide 1 agonist

0.054 0.053 CHEMBL3544623

0.082 0.033 CHEMBL3544626

CHEMBL3544626
0.0110.5550.067Human rhinovirus A protease inhibitor

0.067 0.03 CHEMBL3544622

CHEMBL3544622
0.0040.5590.043Complement C3a chemotactic receptor antagonist

0.041 0.032 CHEMBL3544623

0.043 0.031 CHEMBL3544626

0.039 0.034 CHEMBL1741437

CHEMBL3544626
0.0020.5610.029Prostacyclin agonist

0.014 0.013 CHEMBL3544790

0.022 0.008 CHEMBL3544623

0.029 0.006 CHEMBL3544625

0.026 0.006 CHEMBL3544626

CHEMBL3544625
0.0040.5660.117Diacylglycerol O-acyltransferase 1 inhibitor

0.117 0.005 CHEMBL1741437

CHEMBL1741437
0.0240.5870.239Amyloid beta aggregation inhibitor

0.239 0.061 CHEMBL3544721

0.205 0.075 CHEMBL3544622

0.151 0.107 CHEMBL3544790

0.201 0.077 CHEMBL3544600

0.2 0.078 CHEMBL3544625

CHEMBL3544721
0.0130.5770.313Phospholipase A2 inhibitor

0.123 0.112 CHEMBL3544721

0.264 0.02 CHEMBL3544622

0.313 0.012 CHEMBL3544790

0.15 0.074 CHEMBL3544600

0.275 0.018 CHEMBL3544623

0.164 0.063 CHEMBL3544625

0.252 0.023 CHEMBL3544626

0.189 0.049 CHEMBL1741437

CHEMBL3544790
0.0280.5940.288Platelet adhesion inhibitor

0.261 0.046 CHEMBL3544704

0.223 0.06 CHEMBL3544790

0.287 0.038 CHEMBL3544598

0.288 0.038 CHEMBL3544623

0.195 0.074 CHEMBL3544624

0.141 0.116 CHEMBL3544625

0.181 0.082 CHEMBL3544626

0.202 0.07 CHEMBL1741437

CHEMBL3544623
0.0110.580.073Antibiotic Aminoglycoside-like

0.037 0.024 CHEMBL3544704

0.035 0.027 CHEMBL3559662

0.073 0.005 CHEMBL3544598

CHEMBL3544598
0.0050.5750.305Selectin antagonist

0.066 0.045 CHEMBL3544704

0.072 0.041 CHEMBL3544622

0.077 0.038 CHEMBL3544790

0.076 0.039 CHEMBL3544600

0.305 0.005 CHEMBL3544598

0.073 0.041 CHEMBL3544623

0.084 0.035 CHEMBL3544626

0.098 0.028 CHEMBL1741437

CHEMBL3544598
0.0160.5870.352Thrombolytic

0.213 0.046 CHEMBL3544790

0.226 0.041 CHEMBL3544598

0.19 0.057 CHEMBL3544623

0.157 0.077 CHEMBL3544625

0.352 0.016 CHEMBL3544626

0.288 0.026 CHEMBL1741437

CHEMBL3544626
0.0050.5770.061Liver X receptor antagonist

0.061 0.008 CHEMBL1741437

CHEMBL1741437
0.0250.5980.272Nitric oxide antagonist

0.142 0.102 CHEMBL3544704

0.126 0.125 CHEMBL3544790

0.26 0.049 CHEMBL3544598

0.13 0.118 CHEMBL3544623

0.272 0.046 CHEMBL3544624

0.137 0.109 CHEMBL3544625

CHEMBL3544624
0.0010.5840.019Purinergic P2 agonist

0.019 0.007 CHEMBL3544704

0.017 0.008 CHEMBL3559662

CHEMBL3544704
0.0010.5840.019Purinergic receptor agonist

0.019 0.007 CHEMBL3544704

0.017 0.008 CHEMBL3559662

CHEMBL3544704
0.0070.590.077Lipase inhibitor

0.077 0.046 CHEMBL3544626

CHEMBL3544626
0.0030.590.052Sphingosine 1-phosphate receptor 3 agonist

0.029 0.028 CHEMBL3544790

0.052 0.015 CHEMBL3544626

CHEMBL3544626
0.0530.6430.227Catenin beta inhibitor

0.144 0.121 CHEMBL3544622

0.227 0.017 CHEMBL3544790

0.151 0.105 CHEMBL3544623

0.194 0.037 CHEMBL3544626

0.163 0.078 CHEMBL1741437

CHEMBL3544790
0.0080.5980.154Leukotriene synthesis inhibitor

0.118 0.017 CHEMBL3544790

0.137 0.012 CHEMBL3544623

0.105 0.024 CHEMBL3544625

0.154 0.009 CHEMBL3544626

0.114 0.019 CHEMBL1741437

CHEMBL3544626
0.0060.5970.048Endothelin-converting enzyme inhibitor

0.048 0.032 CHEMBL3544626

CHEMBL3544626
0.0020.5930.023Calcium-dependent phospholipase A2 inhibitor

0.012 0.008 CHEMBL3544721

0.021 0.004 CHEMBL3544622

0.023 0.004 CHEMBL3544790

0.015 0.006 CHEMBL3544600

0.013 0.008 CHEMBL3544626

CHEMBL3544790
0.0090.6150.043Purinergic P2Y2 antagonist

0.043 0.014 CHEMBL3544704

0.035 0.021 CHEMBL3559662

CHEMBL3544704
0.0140.6240.17Histone deacetylase class III inhibitor

0.138 0.054 CHEMBL3544721

0.147 0.046 CHEMBL3544622

0.113 0.077 CHEMBL3544600

0.127 0.064 CHEMBL3544624

0.17 0.031 CHEMBL3544626

0.116 0.074 CHEMBL1741437

CHEMBL3544626
0.0220.6410.244DNA polymerase I inhibitor

0.232 0.02 CHEMBL3544704

0.244 0.018 CHEMBL3559662

0.129 0.062 CHEMBL3544790

0.124 0.065 CHEMBL3544598

0.097 0.09 CHEMBL3544623

0.094 0.093 CHEMBL3544624

0.194 0.03 CHEMBL3544626

CHEMBL3559662
0.0190.640.131Farnesoid X receptor antagonist

0.128 0.087 CHEMBL3544790

0.13 0.083 CHEMBL3544623

0.131 0.081 CHEMBL3544626

0.121 0.102 CHEMBL1741437

CHEMBL3544626
0.0030.6260.052Thyroid hormone alpha antagonist

0.02 0.008 CHEMBL3544790

0.052 0.004 CHEMBL1741437

CHEMBL1741437
0.0010.6290.014Purinergic P2Y agonist

0.014 0.007 CHEMBL3544704

0.013 0.008 CHEMBL3559662

CHEMBL3544704
0.0090.6480.03Toll-Like receptor 4 agonist

0.03 0.012 CHEMBL3544598

CHEMBL3544598
0.0040.6480.044Protein 30S ribosomal subunit inhibitor

0.044 0.009 CHEMBL3544598

CHEMBL3544598
0.0060.650.086HIV-1 reverse transcriptase inhibitor

0.086 0.038 CHEMBL3544621

CHEMBL3544621
0.0030.6540.496Prostaglandin D2 antagonist

0.022 0.017 CHEMBL3544625

0.058 0.006 CHEMBL3544626

0.496 0.003 CHEMBL1741437

CHEMBL1741437
0.0120.6660.332Free radical scavenger

0.169 0.125 CHEMBL3544704

0.211 0.089 CHEMBL3544790

0.332 0.043 CHEMBL3544598

0.2 0.098 CHEMBL3544625

0.156 0.138 CHEMBL3544626

CHEMBL3544598
0.0050.660.037Melatonin 1 agonist

0.037 0.018 CHEMBL3544600

CHEMBL3544600
0.0040.6690.07Microtubule stabilization

0.07 0.007 CHEMBL3544624

CHEMBL3544624
0.0010.6690.011Phosphoribosylglycinamide formyltransferase inhibitor

0.008 0.005 CHEMBL3544623

0.011 0.003 CHEMBL3544626

CHEMBL3544626
0.0030.6720.041Adenosine A1 receptor agonist

0.041 0.007 CHEMBL3544704

0.039 0.008 CHEMBL3559662

CHEMBL3544704
0.010.6810.129Aminoacyl-tRNA synthetase inhibitor

0.129 0.026 CHEMBL3544704

0.101 0.044 CHEMBL3559662

0.082 0.074 CHEMBL3544623

CHEMBL3544704
0.0240.6980.248ABCA1 expression enhancer

0.113 0.036 CHEMBL3544625

0.13 0.024 CHEMBL3544626

0.248 0.006 CHEMBL1741437

CHEMBL1741437
0.0250.7030.283Interleukin 4 antagonist

0.283 0.01 CHEMBL3544623

0.171 0.034 CHEMBL3544625

0.157 0.043 CHEMBL3544626

0.192 0.025 CHEMBL1741437

CHEMBL3544623
0.020.70.195Interleukin 5 antagonist

0.195 0.005 CHEMBL3544623

0.098 0.043 CHEMBL1741437

CHEMBL3544623
0.0110.6980.093ATPase (Vacuolar H+) inhibitor

0.09 0.056 CHEMBL3544598

0.093 0.051 CHEMBL3544624

CHEMBL3544624
0.0040.6940.033Nicotinic acid receptor 2 agonist

0.033 0.028 CHEMBL3544626

CHEMBL3544626
0.010.7060.245Dual specificity phosphatase 3 inhibitor

0.245 0.042 CHEMBL3544790

0.134 0.111 CHEMBL1741437

CHEMBL3544790
0.0020.7060.06Free fatty acid receptor 1 agonist

0.022 0.009 CHEMBL3544790

0.024 0.008 CHEMBL3544623

0.06 0.004 CHEMBL3544626

0.043 0.005 CHEMBL1741437

CHEMBL3544626
0.0040.7120.064Macrophage elastase inhibitor

0.043 0.03 CHEMBL3544790

0.064 0.017 CHEMBL3544626

0.046 0.027 CHEMBL1741437

CHEMBL3544626
0.0350.7460.097Factor V inhibitor

0.097 0.076 CHEMBL3544721

CHEMBL3544721
0.0080.7230.093Topoisomerase II alpha inhibitor

0.093 0.044 CHEMBL3544598

CHEMBL3544598
0.0030.7180.049HMG CoA reductase inhibitor

0.035 0.023 CHEMBL3544623

0.045 0.01 CHEMBL3544624

0.049 0.007 CHEMBL3544625

0.035 0.022 CHEMBL3544626

CHEMBL3544625
0.0060.7240.11Maillard reaction inhibitor

0.11 0.013 CHEMBL3544623

0.073 0.028 CHEMBL3544626

0.053 0.04 CHEMBL1741437

CHEMBL3544623
0.0270.7480.805Cyclophilin D inhibitor

0.495 0.052 CHEMBL3544704

0.291 0.171 CHEMBL3559662

0.426 0.077 CHEMBL3544790

0.805 0.006 CHEMBL3544598

0.631 0.022 CHEMBL3544623

0.405 0.088 CHEMBL3544625

0.531 0.042 CHEMBL3544626

0.591 0.029 CHEMBL1741437

CHEMBL3544598
0.0110.7330.378Antioxidant

0.192 0.12 CHEMBL3544704

0.199 0.114 CHEMBL3544790

0.378 0.039 CHEMBL3544598

0.161 0.152 CHEMBL3544623

0.202 0.112 CHEMBL3544624

0.238 0.091 CHEMBL3544625

0.205 0.11 CHEMBL3544626

CHEMBL3544598
0.0050.7280.176CDC25B inhibitor

0.093 0.019 CHEMBL3544721

0.103 0.015 CHEMBL3544622

0.176 0.005 CHEMBL3544790

0.103 0.015 CHEMBL3544600

CHEMBL3544790
0.0110.7350.231Dual specificity phosphatase inhibitor

0.231 0.043 CHEMBL3544790

0.19 0.06 CHEMBL3544623

0.133 0.116 CHEMBL3544626

CHEMBL3544790
0.010.7340.049Glutamate (mGluR8) antagonist

0.039 0.019 CHEMBL3544790

0.036 0.023 CHEMBL3544623

0.033 0.031 CHEMBL3544625

0.049 0.009 CHEMBL3544626

0.038 0.02 CHEMBL1741437

CHEMBL3544626
0.0050.7410.036Retinoic acid alpha receptor agonist

0.036 0.033 CHEMBL3544625

CHEMBL3544625
0.0150.7530.1DNA helicase inhibitor

0.051 0.047 CHEMBL3544790

0.052 0.043 CHEMBL3544626

0.1 0.005 CHEMBL1741437

CHEMBL1741437
0.0030.750.095Prostaglandin D2 agonist

0.046 0.009 CHEMBL3544790

0.095 0.003 CHEMBL3544623

0.045 0.01 CHEMBL3544625

0.048 0.008 CHEMBL3544626

0.032 0.019 CHEMBL1741437

CHEMBL3544623
0.0040.7610.614Prostaglandin antagonist

0.1 0.017 CHEMBL3544790

0.133 0.012 CHEMBL3544623

0.222 0.006 CHEMBL3544625

0.23 0.005 CHEMBL3544626

0.614 0.003 CHEMBL1741437

CHEMBL1741437
0.0230.7850.112Transcription factor NF kappa B stimulant

0.085 0.059 CHEMBL3544704

0.082 0.064 CHEMBL3544622

0.08 0.069 CHEMBL3559662

0.086 0.058 CHEMBL3544790

0.082 0.065 CHEMBL3544600

0.112 0.03 CHEMBL3544598

0.087 0.055 CHEMBL3544623

0.077 0.076 CHEMBL3544625

0.085 0.06 CHEMBL3544626

CHEMBL3544598
0.0040.7680.057Liver X receptor agonist

0.057 0.018 CHEMBL1741437

CHEMBL1741437
0.0040.770.021Retinoic acid gamma receptor agonist

0.021 0.019 CHEMBL3544625

CHEMBL3544625
0.0030.7750.023Leukotriene B4 receptor 2 antagonist

0.023 0.014 CHEMBL3544626

CHEMBL3544626
0.0050.7860.159Plasminogen activator inhibitor antagonist

0.12 0.007 CHEMBL3544790

0.044 0.041 CHEMBL3544623

0.044 0.041 CHEMBL3544625

0.159 0.005 CHEMBL3544626

0.078 0.016 CHEMBL1741437

CHEMBL3544626
0.0010.7840.019N-Acetylated alpha-linked acidic dipeptidase inhibitor

0.019 0.008 CHEMBL3544626

CHEMBL3544626
0.0040.7880.116HIV-1 integrase (Strand Transfer) inhibitor

0.116 0.017 CHEMBL3544790

0.069 0.036 CHEMBL3544625

CHEMBL3544790
0.0060.7990.09Protease inhibitor

0.09 0.074 CHEMBL3544622

CHEMBL3544622
0.0030.7980.073Prostacyclin antagonist

0.058 0.01 CHEMBL3544790

0.035 0.021 CHEMBL3544623

0.05 0.013 CHEMBL3544625

0.073 0.006 CHEMBL3544626

0.061 0.009 CHEMBL1741437

CHEMBL3544626
0.0020.8130.084Prostaglandin EP3 antagonist

0.035 0.017 CHEMBL3544623

0.084 0.007 CHEMBL3544625

0.041 0.014 CHEMBL3544626

CHEMBL3544625
0.0030.8290.017Adenosine A2b receptor agonist

0.017 0.008 CHEMBL3544704

0.016 0.008 CHEMBL3559662

CHEMBL3544704
0.0050.8460.452Hypolipemic

0.268 0.06 CHEMBL3544599

0.22 0.082 CHEMBL3544790

0.188 0.103 CHEMBL3544598

0.452 0.017 CHEMBL3544623

0.195 0.098 CHEMBL3544624

0.431 0.02 CHEMBL3544625

0.328 0.041 CHEMBL3544626

0.322 0.042 CHEMBL1741437

CHEMBL3544623
0.0020.8440.073Leukotriene B4 receptor 1 antagonist

0.034 0.015 CHEMBL3544790

0.073 0.004 CHEMBL3544623

0.033 0.016 CHEMBL3544625

0.051 0.007 CHEMBL3544626

0.029 0.019 CHEMBL1741437

CHEMBL3544623
0.0040.8540.197Peroxisome proliferator-activated receptor gamma agonist

0.098 0.029 CHEMBL3544790

0.103 0.026 CHEMBL3544623

0.093 0.032 CHEMBL3544625

0.157 0.011 CHEMBL3544626

0.197 0.007 CHEMBL1741437

CHEMBL1741437
0.0030.8550.335Prostaglandin EP2 antagonist

0.153 0.009 CHEMBL3544790

0.302 0.004 CHEMBL3544623

0.335 0.004 CHEMBL3544625

0.194 0.007 CHEMBL3544626

0.168 0.008 CHEMBL1741437

CHEMBL3544625
0.0120.8680.069Adenine nucleotide translocase inhibitor

0.069 0.016 CHEMBL3544704

0.06 0.029 CHEMBL3559662

CHEMBL3544704
0.0020.8680.059Leukotriene D4 antagonist

0.029 0.016 CHEMBL3544790

0.026 0.018 CHEMBL3544623

0.045 0.011 CHEMBL3544625

0.059 0.009 CHEMBL3544626

CHEMBL3544626
0.0040.8710.069HIV-1 integrase (3'-Processing) inhibitor

0.064 0.043 CHEMBL3544790

0.069 0.04 CHEMBL3544625

CHEMBL3544625
0.0090.8820.06Potassium channel large-conductance Ca-activated activator

0.06 0.059 CHEMBL1741437

CHEMBL1741437
0.0020.8780.018Prostaglandin EP1 antagonist

0.018 0.015 CHEMBL3544625

CHEMBL3544625
0.0020.880.019Inosine monophosphate dehydrogenase 1 inhibitor

0.019 0.015 CHEMBL3544704

0.018 0.016 CHEMBL3559662

CHEMBL3544704
0.0030.8880.091Prostaglandin E2 antagonist

0.066 0.025 CHEMBL3544623

0.091 0.017 CHEMBL3544625

0.053 0.033 CHEMBL3544626

CHEMBL3544625
0.0050.8930.212Cyclooxygenase 1 inhibitor

0.114 0.086 CHEMBL3544625

0.212 0.03 CHEMBL1741437

CHEMBL1741437
0.0030.8950.134Aldose reductase inhibitor

0.134 0.012 CHEMBL1741437

CHEMBL1741437
0.0040.8990.1565-Lipoxygenase inhibitor

0.15 0.038 CHEMBL3544790

0.089 0.072 CHEMBL3544623

0.156 0.036 CHEMBL3544625

0.097 0.066 CHEMBL3544626

0.09 0.071 CHEMBL1741437

CHEMBL3544625
0.0020.8990.023Thyroid hormone alpha agonist

0.023 0.005 CHEMBL1741437

CHEMBL1741437
0.0040.9040.135Cyclooxygenase 2 inhibitor

0.135 0.066 CHEMBL1741437

CHEMBL1741437
0.0030.9090.13Peroxisome proliferator-activated receptor delta antagonist

0.031 0.029 CHEMBL3544790

0.048 0.01 CHEMBL3544626

0.13 0.005 CHEMBL1741437

CHEMBL1741437
0.0080.9180.041Calcium-independent phospholipase A2 inhibitor

0.041 0.009 CHEMBL3544626

CHEMBL3544626
0.0040.9150.203Cyclooxygenase inhibitor

0.203 0.041 CHEMBL1741437

CHEMBL1741437
0.0040.9520.158CDC25A inhibitor

0.069 0.059 CHEMBL3544622

0.158 0.011 CHEMBL3544790

0.068 0.06 CHEMBL3544600

0.076 0.047 CHEMBL3544623

0.079 0.044 CHEMBL3544626

0.069 0.058 CHEMBL1741437

CHEMBL3544790
0.0040.9730.162Protein-tyrosine phosphatase inhibitor

0.162 0.068 CHEMBL3544790

0.137 0.093 CHEMBL3544625

0.137 0.093 CHEMBL3544626

CHEMBL3544790
0.0030.9810.111Protein-tyrosine phosphatase 1B inhibitor

0.111 0.069 CHEMBL3544790

0.1 0.078 CHEMBL3544625

CHEMBL3544790
Ext Pa Pi Pmax Activity Other Results ID Pa_max