Anti-pain drug nv1 #225 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Icatibant
DRD4_HUMAN

Docking Scores:
4.05 -5.10
Similarity Score:
40.52%
Best Match:
CHEMBL1771111

L: Nefazodone
DRD4_HUMAN

Docking Scores:
-9.99 -10.10
Similarity Score:
42.86%
Best Match:
CHEMBL199824

L: Balsalazide
DRD4_HUMAN

Docking Scores:
-9.25 -9.12
Similarity Score:
44.09%
Best Match:
CHEMBL57019

L: Alfentanil
DRD4_HUMAN

Docking Scores:
-8.52 -8.60
Similarity Score:
40.14%
Best Match:
CHEMBL3354072

L: Carbamoylcholine
DRD4_HUMAN

Docking Scores:
-4.29 -4.44
Similarity Score:
23.33%
Best Match:
CHEMBL128524

L: Icatibant
EDN1_HUMAN

Docking Scores:
-8.79
Similarity Score:
N/A
Best Match:
N/A

L: Nefazodone
EDN1_HUMAN

Docking Scores:
-8.37
Similarity Score:
N/A
Best Match:
N/A

L: Balsalazide
EDN1_HUMAN

Docking Scores:
-7.53
Similarity Score:
N/A
Best Match:
N/A

L: Alfentanil
EDN1_HUMAN

Docking Scores:
-7.78
Similarity Score:
N/A
Best Match:
N/A

L: Carbamoylcholine
EDN1_HUMAN

Docking Scores:
-3.83
Similarity Score:
N/A
Best Match:
N/A

L: Icatibant
ESR1_HUMAN

Docking Scores:
-1.21 -6.91 -5.63
Similarity Score:
46.34%
Best Match:
CHEMBL241042

L: Nefazodone
ESR1_HUMAN

Docking Scores:
-9.23 -8.65 -7.91
Similarity Score:
35.00%
Best Match:
CHEMBL1462307

L: Balsalazide
ESR1_HUMAN

Docking Scores:
-8.19 -7.64 -6.90
Similarity Score:
39.09%
Best Match:
CHEMBL3645266

L: Alfentanil
ESR1_HUMAN

Docking Scores:
-7.83 -7.59 -7.77
Similarity Score:
36.59%
Best Match:
CHEMBL1475062

L: Carbamoylcholine
ESR1_HUMAN

Docking Scores:
-4.49 -4.51 -4.47
Similarity Score:
26.56%
Best Match:
CHEMBL2165350

L: Icatibant
FABP5_HUMAN

Docking Scores:
6.33 -6.84 -7.01
Similarity Score:
28.16%
Best Match:
CHEMBL3938613

L: Nefazodone
FABP5_HUMAN

Docking Scores:
-9.31 -5.12 -5.47
Similarity Score:
24.89%
Best Match:
CHEMBL245284

L: Balsalazide
FABP5_HUMAN

Docking Scores:
-5.73 -6.23 -5.86
Similarity Score:
27.27%
Best Match:
CHEMBL3941588

L: Alfentanil
FABP5_HUMAN

Docking Scores:
-8.03 -5.73 -5.76
Similarity Score:
29.00%
Best Match:
CHEMBL3959018

L: Carbamoylcholine
FABP5_HUMAN

Docking Scores:
-4.17 -3.67 -3.63
Similarity Score:
12.82%
Best Match:
CHEMBL82293