anti-pain drug nv2 #226 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Sulfasalazine
CASP1_HUMAN

Docking Scores:
-7.91 -7.84 -7.29
Similarity Score:
34.62%
Best Match:
CHEMBL422849

L: Aceclofenac
CASP1_HUMAN

Docking Scores:
-6.75 -7.25 -6.51
Similarity Score:
38.73%
Best Match:
CHEMBL78154

L: Alclofenac
CASP1_HUMAN

Docking Scores:
-5.25 -5.96 -5.52
Similarity Score:
38.53%
Best Match:
CHEMBL1221503

L: Curcumin
CASP1_HUMAN

Docking Scores:
-6.30 -7.38 -6.15
Similarity Score:
28.12%
Best Match:
CHEMBL602331

L: Fentanyl
CASP1_HUMAN

Docking Scores:
-6.46 -6.95 -6.03
Similarity Score:
46.88%
Best Match:
CHEMBL1221597

L: Sulfasalazine
CDK5_HUMAN

Docking Scores:
-8.09 -8.03 -9.16
Similarity Score:
40.88%
Best Match:
CHEMBL2004892

L: Aceclofenac
CDK5_HUMAN

Docking Scores:
-7.08 -7.99 -7.94
Similarity Score:
38.61%
Best Match:
CHEMBL1991734

L: Alclofenac
CDK5_HUMAN

Docking Scores:
-6.67 -6.92 -7.45
Similarity Score:
30.77%
Best Match:
CHEMBL1998121

L: Curcumin
CDK5_HUMAN

Docking Scores:
-7.35 -8.05 -8.05
Similarity Score:
30.14%
Best Match:
CHEMBL2002407

L: Fentanyl
CDK5_HUMAN

Docking Scores:
-7.76 -7.70 -7.16
Similarity Score:
43.33%
Best Match:
CHEMBL1998121

L: Sulfasalazine
CHLE_HUMAN

Docking Scores:
-8.62 -8.90 -8.84
Similarity Score:
28.63%
Best Match:
CHEMBL3925612

L: Aceclofenac
CHLE_HUMAN

Docking Scores:
-8.62 -8.12 -8.40
Similarity Score:
40.52%
Best Match:
CHEMBL3087676

L: Alclofenac
CHLE_HUMAN

Docking Scores:
-6.97 -6.80 -6.78
Similarity Score:
42.72%
Best Match:
CHEMBL288482

L: Curcumin
CHLE_HUMAN

Docking Scores:
-9.31 -8.76 -8.78
Similarity Score:
54.90%
Best Match:
CHEMBL2381390

L: Fentanyl
CHLE_HUMAN

Docking Scores:
-8.47 -8.99 -9.56
Similarity Score:
52.63%
Best Match:
CHEMBL4077192

L: Sulfasalazine
CNR1_HUMAN

Docking Scores:
-10.11 -10.90 -9.35
Similarity Score:
41.81%
Best Match:
CHEMBL247332

L: Aceclofenac
CNR1_HUMAN

Docking Scores:
-8.53 -8.27 -9.05
Similarity Score:
44.96%
Best Match:
CHEMBL3936647

L: Alclofenac
CNR1_HUMAN

Docking Scores:
-7.04 -6.94 -7.07
Similarity Score:
49.38%
Best Match:
CHEMBL244607

L: Curcumin
CNR1_HUMAN

Docking Scores:
-6.96 -9.02 -9.92
Similarity Score:
42.62%
Best Match:
CHEMBL395230

L: Fentanyl
CNR1_HUMAN

Docking Scores:
-8.98 -9.23 -9.76
Similarity Score:
55.95%
Best Match:
CHEMBL479095