anti-pain drug v3 #222 Output Download CSV

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

Docking Scores:
-6.25
Similarity Score:
40.00%
Best Match:
CHEMBL334255

L: Alfentanil
FYN_HUMAN

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

L: Pimecrolimus
FYN_HUMAN

Docking Scores:
-8.14
Similarity Score:
35.15%
Best Match:
CHEMBL1221512

L: Levacetylmethadol
FYN_HUMAN

Docking Scores:
-6.56
Similarity Score:
46.46%
Best Match:
CHEMBL305660

L: Rofecoxib
FYN_HUMAN

Docking Scores:
-9.04
Similarity Score:
29.09%
Best Match:
CHEMBL1221512

L: Amantadine
GLRA3_HUMAN

Docking Scores:
-5.92 -5.94 -5.95
Similarity Score:
4.64%
Best Match:
CHEMBL4070615

L: Amantadine
GLRA3_HUMAN

Docking Scores:
-7.26
Similarity Score:
4.64%
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: Pimecrolimus
GLRA3_HUMAN

Docking Scores:
-7.67 -6.64 -7.26
Similarity Score:
19.93%
Best Match:
CHEMBL4070615

L: Pimecrolimus
GLRA3_HUMAN

Docking Scores:
-6.80
Similarity Score:
19.93%
Best Match:
CHEMBL4070615

L: Levacetylmethadol
GLRA3_HUMAN

Docking Scores:
-7.55 -7.00 -7.00
Similarity Score:
17.81%
Best Match:
CHEMBL4070615

L: Levacetylmethadol
GLRA3_HUMAN

Docking Scores:
-8.14
Similarity Score:
17.81%
Best Match:
CHEMBL4070615

L: Rofecoxib
GLRA3_HUMAN

Docking Scores:
-8.90 -9.16 -8.83
Similarity Score:
19.40%
Best Match:
CHEMBL4070615

L: Rofecoxib
GLRA3_HUMAN

Docking Scores:
-9.56
Similarity Score:
19.40%
Best Match:
CHEMBL4070615

L: Amantadine
GRM5_HUMAN

Docking Scores:
-6.87 -4.63 -4.89
Similarity Score:
38.24%
Best Match:
CHEMBL1783985

L: Alfentanil
GRM5_HUMAN

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

L: Pimecrolimus
GRM5_HUMAN

Docking Scores:
65.78 77.47 69.91
Similarity Score:
30.77%
Best Match:
CHEMBL3086720

L: Levacetylmethadol
GRM5_HUMAN

Docking Scores:
-4.55 -1.44 -1.18
Similarity Score:
42.59%
Best Match:
CHEMBL92162

L: Rofecoxib
GRM5_HUMAN

Docking Scores:
-8.77 -8.64 -7.93
Similarity Score:
32.06%
Best Match:
CHEMBL92162