anti-pain drug nv2 #226 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Sulfasalazine
DRD4_HUMAN

Docking Scores:
-10.37 -10.44
Similarity Score:
33.33%
Best Match:
CHEMBL3409256

L: Aceclofenac
DRD4_HUMAN

Docking Scores:
-8.02 -7.90
Similarity Score:
34.25%
Best Match:
CHEMBL330108

L: Alclofenac
DRD4_HUMAN

Docking Scores:
-6.24 -6.36
Similarity Score:
41.76%
Best Match:
CHEMBL131484

L: Curcumin
DRD4_HUMAN

Docking Scores:
-9.78 -9.85
Similarity Score:
43.40%
Best Match:
CHEMBL2112284

L: Fentanyl
DRD4_HUMAN

Docking Scores:
-8.89 -8.94
Similarity Score:
70.79%
Best Match:
CHEMBL4074104

L: Sulfasalazine
EDN1_HUMAN

Docking Scores:
-8.43
Similarity Score:
N/A
Best Match:
N/A

L: Aceclofenac
EDN1_HUMAN

Docking Scores:
-7.06
Similarity Score:
N/A
Best Match:
N/A

L: Alclofenac
EDN1_HUMAN

Docking Scores:
-6.62
Similarity Score:
N/A
Best Match:
N/A

L: Curcumin
EDN1_HUMAN

Docking Scores:
-8.05
Similarity Score:
N/A
Best Match:
N/A

L: Fentanyl
EDN1_HUMAN

Docking Scores:
-7.64
Similarity Score:
N/A
Best Match:
N/A

L: Sulfasalazine
ESR1_HUMAN

Docking Scores:
-8.95 -8.43 -8.64
Similarity Score:
41.84%
Best Match:
CHEMBL202691

L: Aceclofenac
ESR1_HUMAN

Docking Scores:
-7.81 -7.78 -7.85
Similarity Score:
32.71%
Best Match:
CHEMBL2071175

L: Alclofenac
ESR1_HUMAN

Docking Scores:
-6.44 -6.57 -6.50
Similarity Score:
48.75%
Best Match:
CHEMBL335412

L: Curcumin
ESR1_HUMAN

Docking Scores:
-8.48 -7.86 -8.18
Similarity Score:
61.45%
Best Match:
CHEMBL4101656

L: Fentanyl
ESR1_HUMAN

Docking Scores:
-8.30 -8.48 -8.48
Similarity Score:
50.89%
Best Match:
CHEMBL3360843

L: Sulfasalazine
FABP5_HUMAN

Docking Scores:
-8.20 -6.61 -6.49
Similarity Score:
29.23%
Best Match:
CHEMBL3941588

L: Aceclofenac
FABP5_HUMAN

Docking Scores:
-7.49 -5.51 -5.44
Similarity Score:
34.31%
Best Match:
CHEMBL437489

L: Alclofenac
FABP5_HUMAN

Docking Scores:
-6.20 -4.38 -4.49
Similarity Score:
47.57%
Best Match:
CHEMBL212860

L: Curcumin
FABP5_HUMAN

Docking Scores:
-8.03 -6.03 -5.84
Similarity Score:
27.50%
Best Match:
CHEMBL212860

L: Fentanyl
FABP5_HUMAN

Docking Scores:
-7.92 -6.05 -6.03
Similarity Score:
30.07%
Best Match:
CHEMBL3941588