LTJv2 #75 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Etoricoxib
ACHA9_HUMAN

Docking Scores:
-7.11
Similarity Score:
20.81%
Best Match:
CHEMBL386114

L: Indomethacin
ACHA9_HUMAN

Docking Scores:
-7.17
Similarity Score:
33.80%
Best Match:
CHEMBL386114

L: Fenbufen
ACHA9_HUMAN

Docking Scores:
-7.17
Similarity Score:
20.81%
Best Match:
CHEMBL386114

L: Celecoxib
ACHA9_HUMAN

Docking Scores:
-8.12
Similarity Score:
23.18%
Best Match:
CHEMBL386114

L: Diclofenac
ACHA9_HUMAN

Docking Scores:
-7.09
Similarity Score:
17.01%
Best Match:
CHEMBL386114

L: Etoricoxib
ACHB2_HUMAN

Docking Scores:
-5.15 -6.81 -6.60
Similarity Score:
N/A
Best Match:
N/A

L: Indomethacin
ACHB2_HUMAN

Docking Scores:
-4.17 -2.49 -2.93
Similarity Score:
N/A
Best Match:
N/A

L: Fenbufen
ACHB2_HUMAN

Docking Scores:
-7.00 -8.38 -8.60
Similarity Score:
N/A
Best Match:
N/A

L: Celecoxib
ACHB2_HUMAN

Docking Scores:
-6.72 -5.70 -6.56
Similarity Score:
N/A
Best Match:
N/A

L: Diclofenac
ACHB2_HUMAN

Docking Scores:
-6.54 -8.23 -6.56
Similarity Score:
N/A
Best Match:
N/A

L: Etoricoxib
ACM1_HUMAN

Docking Scores:
-9.45 -3.41
Similarity Score:
36.09%
Best Match:
CHEMBL3600828

L: Indomethacin
ACM1_HUMAN

Docking Scores:
-7.97 1.86
Similarity Score:
50.00%
Best Match:
CHEMBL3126661

L: Fenbufen
ACM1_HUMAN

Docking Scores:
-8.91 -7.13
Similarity Score:
46.34%
Best Match:
CHEMBL2107687

L: Celecoxib
ACM1_HUMAN

Docking Scores:
-9.68 -3.98
Similarity Score:
46.45%
Best Match:
CHEMBL600217

L: Diclofenac
ACM1_HUMAN

Docking Scores:
-8.76 -4.91
Similarity Score:
46.53%
Best Match:
CHEMBL415

L: Etoricoxib
ACM4_HUMAN

Docking Scores:
-9.52 -8.73
Similarity Score:
32.24%
Best Match:
CHEMBL40391

L: Indomethacin
ACM4_HUMAN

Docking Scores:
-8.68 -9.94
Similarity Score:
43.75%
Best Match:
CHEMBL104332

L: Fenbufen
ACM4_HUMAN

Docking Scores:
-8.85 -8.71
Similarity Score:
46.34%
Best Match:
CHEMBL2107687

L: Celecoxib
ACM4_HUMAN

Docking Scores:
-10.42 -8.55
Similarity Score:
39.53%
Best Match:
CHEMBL244946

L: Diclofenac
ACM4_HUMAN

Docking Scores:
-8.67 -7.51
Similarity Score:
46.53%
Best Match:
CHEMBL415