LTJv2 #75 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Etoricoxib
AA1R_HUMAN

Docking Scores:
-9.64 -9.37 -8.70
Similarity Score:
47.22%
Best Match:
CHEMBL223828

L: Indomethacin
AA1R_HUMAN

Docking Scores:
-9.21 -8.81 -9.96
Similarity Score:
50.67%
Best Match:
CHEMBL2435536

L: Fenbufen
AA1R_HUMAN

Docking Scores:
-8.39 -9.30 -8.69
Similarity Score:
30.36%
Best Match:
CHEMBL221407

L: Celecoxib
AA1R_HUMAN

Docking Scores:
-9.61 -9.46 -8.44
Similarity Score:
38.32%
Best Match:
CHEMBL1955923

L: Diclofenac
AA1R_HUMAN

Docking Scores:
-7.29 -7.36 -7.74
Similarity Score:
29.75%
Best Match:
CHEMBL2260644

L: Etoricoxib
AA2AR_HUMAN

Docking Scores:
-9.61 -9.73 -9.96
Similarity Score:
54.36%
Best Match:
CHEMBL448781

L: Indomethacin
AA2AR_HUMAN

Docking Scores:
-9.37 -9.57 -9.92
Similarity Score:
42.86%
Best Match:
CHEMBL3677906

L: Fenbufen
AA2AR_HUMAN

Docking Scores:
-8.52 -8.62 -8.64
Similarity Score:
29.31%
Best Match:
CHEMBL225460

L: Celecoxib
AA2AR_HUMAN

Docking Scores:
-9.59 -9.79 -10.26
Similarity Score:
39.47%
Best Match:
CHEMBL270654

L: Diclofenac
AA2AR_HUMAN

Docking Scores:
-7.76 -7.71 -8.16
Similarity Score:
34.91%
Best Match:
CHEMBL603094

L: Etoricoxib
ACES_HUMAN

Docking Scores:
-9.79 -9.72 -10.41
Similarity Score:
39.26%
Best Match:
CHEMBL3582228

L: Indomethacin
ACES_HUMAN

Docking Scores:
-9.64 -10.23 -9.76
Similarity Score:
54.07%
Best Match:
CHEMBL4102333

L: Fenbufen
ACES_HUMAN

Docking Scores:
-8.61 -8.39 -9.47
Similarity Score:
58.73%
Best Match:
CHEMBL157327

L: Celecoxib
ACES_HUMAN

Docking Scores:
-10.83 -10.93 -9.78
Similarity Score:
41.85%
Best Match:
CHEMBL87014

L: Diclofenac
ACES_HUMAN

Docking Scores:
-8.71 -8.16 -9.38
Similarity Score:
35.43%
Best Match:
CHEMBL1085858

L: Etoricoxib
ACE_HUMAN

Docking Scores:
-8.57 -8.67 -6.72
Similarity Score:
29.08%
Best Match:
CHEMBL191

L: Indomethacin
ACE_HUMAN

Docking Scores:
-8.44 -8.58 -7.49
Similarity Score:
46.11%
Best Match:
CHEMBL305388

L: Fenbufen
ACE_HUMAN

Docking Scores:
-8.59 -7.26 -7.07
Similarity Score:
43.82%
Best Match:
CHEMBL258333

L: Celecoxib
ACE_HUMAN

Docking Scores:
-8.65 -9.04 -6.36
Similarity Score:
28.64%
Best Match:
CHEMBL3414814

L: Diclofenac
ACE_HUMAN

Docking Scores:
-7.45 -7.41 -7.29
Similarity Score:
29.63%
Best Match:
CHEMBL23849