Anti-pain drug nv1 #225 Output Download CSV

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

Docking Scores:
-8.04
Similarity Score:
38.53%
Best Match:
CHEMBL432649

L: Nefazodone
FYN_HUMAN

Docking Scores:
-8.53
Similarity Score:
33.33%
Best Match:
CHEMBL3824089

L: Balsalazide
FYN_HUMAN

Docking Scores:
-8.68
Similarity Score:
42.62%
Best Match:
CHEMBL1988141

L: Alfentanil
FYN_HUMAN

Docking Scores:
-7.15
Similarity Score:
34.56%
Best Match:
CHEMBL407135

L: Carbamoylcholine
FYN_HUMAN

Docking Scores:
-3.94
Similarity Score:
16.47%
Best Match:
CHEMBL221753

L: Icatibant
GLRA3_HUMAN

Docking Scores:
12.67 -2.93 -7.14
Similarity Score:
25.43%
Best Match:
CHEMBL4070615

L: Icatibant
GLRA3_HUMAN

Docking Scores:
-7.57
Similarity Score:
25.43%
Best Match:
CHEMBL4070615

L: Nefazodone
GLRA3_HUMAN

Docking Scores:
-8.49 -8.25 -9.18
Similarity Score:
20.28%
Best Match:
CHEMBL4070615

L: Nefazodone
GLRA3_HUMAN

Docking Scores:
-8.57
Similarity Score:
20.28%
Best Match:
CHEMBL4070615

L: Balsalazide
GLRA3_HUMAN

Docking Scores:
-7.20 -7.93 -7.81
Similarity Score:
18.41%
Best Match:
CHEMBL4070615

L: Balsalazide
GLRA3_HUMAN

Docking Scores:
-8.27
Similarity Score:
18.41%
Best Match:
CHEMBL4070615

L: Alfentanil
GLRA3_HUMAN

Docking Scores:
-7.82 -7.83 -7.56
Similarity Score:
24.08%
Best Match:
CHEMBL4070615

L: Alfentanil
GLRA3_HUMAN

Docking Scores:
-8.90
Similarity Score:
24.08%
Best Match:
CHEMBL4070615

L: Carbamoylcholine
GLRA3_HUMAN

Docking Scores:
-4.27 -4.51 -4.55
Similarity Score:
6.44%
Best Match:
CHEMBL4070615

L: Carbamoylcholine
GLRA3_HUMAN

Docking Scores:
-4.45
Similarity Score:
6.44%
Best Match:
CHEMBL4070615

L: Icatibant
GRM5_HUMAN

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?

L: Nefazodone
GRM5_HUMAN

Docking Scores:
-9.31 -9.38 -8.53
Similarity Score:
34.75%
Best Match:
CHEMBL3633955

L: Balsalazide
GRM5_HUMAN

Docking Scores:
-9.22 -7.08 -7.14
Similarity Score:
42.86%
Best Match:
CHEMBL2151818

L: Alfentanil
GRM5_HUMAN

Docking Scores:
-6.93 -6.31 -6.10
Similarity Score:
40.12%
Best Match:
CHEMBL3939327

L: Carbamoylcholine
GRM5_HUMAN

Docking Scores:
-4.64 -4.66 -4.61
Similarity Score:
20.00%
Best Match:
CHEMBL1290670