LTJv2 #75 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Etoricoxib
ADRB2_HUMAN

Docking Scores:
-9.43 -8.48 -9.72
Similarity Score:
42.14%
Best Match:
CHEMBL1483308

L: Indomethacin
ADRB2_HUMAN

Docking Scores:
-8.76 -9.08 -8.71
Similarity Score:
49.69%
Best Match:
CHEMBL444553

L: Fenbufen
ADRB2_HUMAN

Docking Scores:
-7.91 -9.23 -8.67
Similarity Score:
39.80%
Best Match:
CHEMBL270964

L: Celecoxib
ADRB2_HUMAN

Docking Scores:
-9.17 -9.18 -9.57
Similarity Score:
43.37%
Best Match:
CHEMBL101606

L: Diclofenac
ADRB2_HUMAN

Docking Scores:
-7.35 -8.61 -8.50
Similarity Score:
44.95%
Best Match:
CHEMBL154419

L: Etoricoxib
AGTR2_HUMAN

Docking Scores:
-9.91 -8.98 -9.96
Similarity Score:
33.87%
Best Match:
CHEMBL1017

L: Indomethacin
AGTR2_HUMAN

Docking Scores:
-8.79 -9.13 -8.95
Similarity Score:
49.25%
Best Match:
CHEMBL40381

L: Fenbufen
AGTR2_HUMAN

Docking Scores:
-8.87 -8.93 -8.57
Similarity Score:
31.71%
Best Match:
CHEMBL290286

L: Celecoxib
AGTR2_HUMAN

Docking Scores:
-9.08 -9.18 -10.08
Similarity Score:
37.45%
Best Match:
CHEMBL263714

L: Diclofenac
AGTR2_HUMAN

Docking Scores:
-7.57 -7.50 -7.34
Similarity Score:
25.67%
Best Match:
CHEMBL40381

L: Etoricoxib
ALDR_HUMAN

Docking Scores:
-8.86 -9.39 -8.80
Similarity Score:
32.20%
Best Match:
CHEMBL1917446

L: Indomethacin
ALDR_HUMAN

Docking Scores:
-8.98 -8.72 -8.53
Similarity Score:
48.50%
Best Match:
CHEMBL1944855

L: Fenbufen
ALDR_HUMAN

Docking Scores:
-8.70 -8.63 -9.33
Similarity Score:
44.30%
Best Match:
CHEMBL51483

L: Celecoxib
ALDR_HUMAN

Docking Scores:
-9.48 -9.48 -9.26
Similarity Score:
30.66%
Best Match:
CHEMBL274727

L: Diclofenac
ALDR_HUMAN

Docking Scores:
-7.93 -7.61 -7.76
Similarity Score:
35.23%
Best Match:
CHEMBL77283

L: Etoricoxib
AMPN_HUMAN

Docking Scores:
-9.06 -9.81 -8.43
Similarity Score:
22.67%
Best Match:
CHEMBL1077591

L: Indomethacin
AMPN_HUMAN

Docking Scores:
-8.25 -9.08 -8.48
Similarity Score:
44.66%
Best Match:
CHEMBL1077591

L: Fenbufen
AMPN_HUMAN

Docking Scores:
-8.31 -9.30 -7.68
Similarity Score:
48.19%
Best Match:
CHEMBL1821978

L: Celecoxib
AMPN_HUMAN

Docking Scores:
-8.74 -9.17 -8.95
Similarity Score:
26.50%
Best Match:
CHEMBL1077591

L: Diclofenac
AMPN_HUMAN

Docking Scores:
-7.15 -8.06 -7.99
Similarity Score:
29.69%
Best Match:
CHEMBL3764432