anti-pain drug v3 #222 Output Download CSV

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

Docking Scores:
-6.16 -6.11 -6.06
Similarity Score:
19.40%
Best Match:
CHEMBL1332942

L: Alfentanil
ADRB2_HUMAN

Docking Scores:
-7.60 -8.62 -8.44
Similarity Score:
40.40%
Best Match:
CHEMBL1459608

L: Pimecrolimus
ADRB2_HUMAN

Docking Scores:
-6.14 9.06 13.36
Similarity Score:
33.58%
Best Match:
CHEMBL3973386

L: Levacetylmethadol
ADRB2_HUMAN

Docking Scores:
-6.21 -7.06 -8.31
Similarity Score:
46.73%
Best Match:
CHEMBL1082607

L: Rofecoxib
ADRB2_HUMAN

Docking Scores:
-9.03 -8.98 -8.85
Similarity Score:
38.31%
Best Match:
CHEMBL446840

L: Amantadine
AGTR2_HUMAN

Docking Scores:
-5.87 -5.99 -5.83
Similarity Score:
8.08%
Best Match:
CHEMBL376286

L: Alfentanil
AGTR2_HUMAN

Docking Scores:
-7.79 -8.13 -7.90
Similarity Score:
34.50%
Best Match:
CHEMBL348157

L: Pimecrolimus
AGTR2_HUMAN

Docking Scores:
-10.54 -9.96 -10.55
Similarity Score:
27.59%
Best Match:
CHEMBL3350599

L: Levacetylmethadol
AGTR2_HUMAN

Docking Scores:
-8.08 -7.85 -7.97
Similarity Score:
32.35%
Best Match:
CHEMBL3350599

L: Rofecoxib
AGTR2_HUMAN

Docking Scores:
-8.89 -8.83 -9.06
Similarity Score:
26.47%
Best Match:
CHEMBL217673

L: Amantadine
ALDR_HUMAN

Docking Scores:
-6.35 -6.40 -6.22
Similarity Score:
9.09%
Best Match:
CHEMBL173813

L: Alfentanil
ALDR_HUMAN

Docking Scores:
-8.03 -7.79 -7.50
Similarity Score:
34.50%
Best Match:
CHEMBL344057

L: Pimecrolimus
ALDR_HUMAN

Docking Scores:
-9.08 -8.38 -8.15
Similarity Score:
32.96%
Best Match:
CHEMBL249448

L: Levacetylmethadol
ALDR_HUMAN

Docking Scores:
-6.36 -6.88 -6.43
Similarity Score:
33.33%
Best Match:
CHEMBL319244

L: Rofecoxib
ALDR_HUMAN

Docking Scores:
-8.47 -8.73 -8.55
Similarity Score:
53.47%
Best Match:
CHEMBL319244

L: Amantadine
AMPN_HUMAN

Docking Scores:
-5.97 -5.38 -5.19
Similarity Score:
38.24%
Best Match:
CHEMBL27519

L: Alfentanil
AMPN_HUMAN

Docking Scores:
-7.96 -8.07 -7.95
Similarity Score:
38.10%
Best Match:
CHEMBL328470

L: Pimecrolimus
AMPN_HUMAN

Docking Scores:
-8.48 -9.78 -8.76
Similarity Score:
33.33%
Best Match:
CHEMBL28650

L: Levacetylmethadol
AMPN_HUMAN

Docking Scores:
-7.60 -7.20 -7.93
Similarity Score:
39.00%
Best Match:
CHEMBL1821978

L: Rofecoxib
AMPN_HUMAN

Docking Scores:
-7.94 -8.98 -8.15
Similarity Score:
25.58%
Best Match:
CHEMBL1782887