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
MTOR_HUMAN

Docking Scores:
-6.55 -6.40 -6.35
Similarity Score:
18.57%
Best Match:
CHEMBL3972399

L: Alfentanil
MTOR_HUMAN

Docking Scores:
-9.17 -8.56 -8.64
Similarity Score:
40.76%
Best Match:
CHEMBL411735

L: Pimecrolimus
MTOR_HUMAN

Docking Scores:
-8.96 -8.89 -8.17
Similarity Score:
92.67%
Best Match:
CHEMBL269732

L: Levacetylmethadol
MTOR_HUMAN

Docking Scores:
-9.00 -9.08 -8.13
Similarity Score:
40.82%
Best Match:
CHEMBL3972399

L: Rofecoxib
MTOR_HUMAN

Docking Scores:
-9.40 -9.45 -9.19
Similarity Score:
27.16%
Best Match:
CHEMBL3701064

L: Amantadine
NEP_HUMAN

Docking Scores:
-5.52 -6.01 -6.46
Similarity Score:
28.89%
Best Match:
CHEMBL211529

L: Alfentanil
NEP_HUMAN

Docking Scores:
-6.57 -6.88 -7.58
Similarity Score:
37.97%
Best Match:
CHEMBL51389

L: Pimecrolimus
NEP_HUMAN

Docking Scores:
-8.94 -8.55 -8.13
Similarity Score:
40.40%
Best Match:
CHEMBL434492

L: Levacetylmethadol
NEP_HUMAN

Docking Scores:
-6.19 -5.94 -5.80
Similarity Score:
53.93%
Best Match:
CHEMBL213404

L: Rofecoxib
NEP_HUMAN

Docking Scores:
-7.82 -7.62 -7.21
Similarity Score:
31.20%
Best Match:
CHEMBL81232

L: Amantadine
NK1R_HUMAN

Docking Scores:
-6.39 -6.68 -5.59
Similarity Score:
20.69%
Best Match:
CHEMBL143813

L: Alfentanil
NK1R_HUMAN

Docking Scores:
-8.49 -7.61 -7.56
Similarity Score:
45.83%
Best Match:
CHEMBL2313628

L: Pimecrolimus
NK1R_HUMAN

Docking Scores:
-8.78 -9.64 -9.74
Similarity Score:
41.49%
Best Match:
CHEMBL538131

L: Levacetylmethadol
NK1R_HUMAN

Docking Scores:
-8.21 -6.30 -6.50
Similarity Score:
65.22%
Best Match:
CHEMBL209531

L: Rofecoxib
NK1R_HUMAN

Docking Scores:
-8.91 -9.40 -9.00
Similarity Score:
30.81%
Best Match:
CHEMBL93184

L: Amantadine
NMDE1_HUMAN

Docking Scores:
-6.00 -5.92 -6.05
Similarity Score:
7.59%
Best Match:
CHEMBL284237

L: Alfentanil
NMDE1_HUMAN

Docking Scores:
-7.75 -6.97 -7.19
Similarity Score:
13.41%
Best Match:
CHEMBL284237

L: Pimecrolimus
NMDE1_HUMAN

Docking Scores:
-9.33 -7.74 -8.94
Similarity Score:
13.24%
Best Match:
CHEMBL2333945

L: Levacetylmethadol
NMDE1_HUMAN

Docking Scores:
-6.47 -6.68 -6.07
Similarity Score:
29.63%
Best Match:
CHEMBL284237

L: Rofecoxib
NMDE1_HUMAN

Docking Scores:
-10.09 -9.70 -10.02
Similarity Score:
18.99%
Best Match:
CHEMBL2333945