LTJv2 #75 Output Download CSV

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

Docking Scores:
-7.61
Similarity Score:
51.09%
Best Match:
CHEMBL585295

L: Indomethacin
PTGES_HUMAN

Docking Scores:
-6.55
Similarity Score:
53.76%
Best Match:
CHEMBL360114

L: Fenbufen
PTGES_HUMAN

Docking Scores:
-6.92
Similarity Score:
37.04%
Best Match:
CHEMBL3608374

L: Celecoxib
PTGES_HUMAN

Docking Scores:
-7.39
Similarity Score:
100.00%
Best Match:
CHEMBL118

L: Diclofenac
PTGES_HUMAN

Docking Scores:
-6.52
Similarity Score:
35.14%
Best Match:
CHEMBL1683859

L: Etoricoxib
SC6A4_HUMAN

Docking Scores:
-9.32 -9.16 -8.96
Similarity Score:
36.67%
Best Match:
CHEMBL2419440

L: Indomethacin
SC6A4_HUMAN

Docking Scores:
-9.36 -8.74 -9.19
Similarity Score:
62.43%
Best Match:
CHEMBL461571

L: Fenbufen
SC6A4_HUMAN

Docking Scores:
-8.90 -8.60 -8.50
Similarity Score:
55.22%
Best Match:
CHEMBL2111613

L: Celecoxib
SC6A4_HUMAN

Docking Scores:
-10.17 -9.89 -9.57
Similarity Score:
38.80%
Best Match:
CHEMBL3703730

L: Diclofenac
SC6A4_HUMAN

Docking Scores:
-8.20 -8.33 -8.76
Similarity Score:
46.53%
Best Match:
CHEMBL415

L: Etoricoxib
SCN9A_HUMAN

Docking Scores:
-8.51
Similarity Score:
46.11%
Best Match:
CHEMBL3682760

L: Indomethacin
SCN9A_HUMAN

Docking Scores:
-7.34
Similarity Score:
59.52%
Best Match:
CHEMBL3941974

L: Fenbufen
SCN9A_HUMAN

Docking Scores:
-9.31
Similarity Score:
36.63%
Best Match:
CHEMBL206758

L: Celecoxib
SCN9A_HUMAN

Docking Scores:
-8.31
Similarity Score:
53.41%
Best Match:
CHEMBL3682673

L: Diclofenac
SCN9A_HUMAN

Docking Scores:
-7.61
Similarity Score:
37.41%
Best Match:
CHEMBL3581050

L: Etoricoxib
TLR4_HUMAN

Docking Scores:
-7.97 -8.33 -7.72
Similarity Score:
24.57%
Best Match:
CHEMBL3823499

L: Indomethacin
TLR4_HUMAN

Docking Scores:
-7.49 -7.73 -7.18
Similarity Score:
38.66%
Best Match:
CHEMBL1223751

L: Fenbufen
TLR4_HUMAN

Docking Scores:
-7.89 -8.43 -7.89
Similarity Score:
25.35%
Best Match:
CHEMBL382272

L: Celecoxib
TLR4_HUMAN

Docking Scores:
-8.20 -8.08 -9.15
Similarity Score:
30.05%
Best Match:
CHEMBL1824677

L: Diclofenac
TLR4_HUMAN

Docking Scores:
-7.37 -7.23 -7.52
Similarity Score:
23.74%
Best Match:
CHEMBL2419459