LTJv2 #75 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Etoricoxib
FYN_HUMAN

Docking Scores:
-9.14
Similarity Score:
40.57%
Best Match:
CHEMBL1997822

L: Indomethacin
FYN_HUMAN

Docking Scores:
-8.57
Similarity Score:
48.52%
Best Match:
CHEMBL1970352

L: Fenbufen
FYN_HUMAN

Docking Scores:
-8.63
Similarity Score:
48.00%
Best Match:
CHEMBL1975923

L: Celecoxib
FYN_HUMAN

Docking Scores:
-9.71
Similarity Score:
39.82%
Best Match:
CHEMBL1999590

L: Diclofenac
FYN_HUMAN

Docking Scores:
-7.93
Similarity Score:
46.43%
Best Match:
CHEMBL1991734

L: Etoricoxib
GLRA3_HUMAN

Docking Scores:
-8.87 -9.04 -8.41
Similarity Score:
20.97%
Best Match:
CHEMBL4070615

L: Etoricoxib
GLRA3_HUMAN

Docking Scores:
-9.20
Similarity Score:
20.97%
Best Match:
CHEMBL4070615

L: Indomethacin
GLRA3_HUMAN

Docking Scores:
-8.55 -8.22 -8.18
Similarity Score:
27.27%
Best Match:
CHEMBL4070615

L: Indomethacin
GLRA3_HUMAN

Docking Scores:
-9.21
Similarity Score:
27.27%
Best Match:
CHEMBL4070615

L: Fenbufen
GLRA3_HUMAN

Docking Scores:
-8.02 -8.18 -8.10
Similarity Score:
13.08%
Best Match:
CHEMBL4070615

L: Fenbufen
GLRA3_HUMAN

Docking Scores:
-9.70
Similarity Score:
13.08%
Best Match:
CHEMBL4070615

L: Celecoxib
GLRA3_HUMAN

Docking Scores:
-9.83 -9.77 -9.36
Similarity Score:
24.51%
Best Match:
CHEMBL4070615

L: Celecoxib
GLRA3_HUMAN

Docking Scores:
-9.95
Similarity Score:
24.51%
Best Match:
CHEMBL4070615

L: Diclofenac
GLRA3_HUMAN

Docking Scores:
-8.85 -8.83 -8.93
Similarity Score:
13.55%
Best Match:
CHEMBL4074873

L: Diclofenac
GLRA3_HUMAN

Docking Scores:
-8.66
Similarity Score:
13.55%
Best Match:
CHEMBL4074873

L: Etoricoxib
GRM5_HUMAN

Docking Scores:
-6.90 -8.85 -7.45
Similarity Score:
46.21%
Best Match:
CHEMBL3603921

L: Indomethacin
GRM5_HUMAN

Docking Scores:
-5.57 -5.30 -5.48
Similarity Score:
44.03%
Best Match:
CHEMBL377706

L: Fenbufen
GRM5_HUMAN

Docking Scores:
-8.83 -9.77 -9.42
Similarity Score:
53.95%
Best Match:
CHEMBL1682795

L: Celecoxib
GRM5_HUMAN

Docking Scores:
-8.12 -8.85 -8.59
Similarity Score:
51.20%
Best Match:
CHEMBL182558

L: Diclofenac
GRM5_HUMAN

Docking Scores:
-7.67 -7.54 -6.82
Similarity Score:
37.01%
Best Match:
CHEMBL239594