anti-pain drug v2 #221 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Aspirin
NTRK1_HUMAN

Docking Scores:
-6.38 -6.45 -6.31
Similarity Score:
32.00%
Best Match:
CHEMBL2004025

L: Mesalazine
NTRK1_HUMAN

Docking Scores:
-5.86 -5.77 -5.62
Similarity Score:
35.65%
Best Match:
CHEMBL2004025

L: Sulfasalazine
NTRK1_HUMAN

Docking Scores:
-8.33 -9.32 -8.51
Similarity Score:
43.48%
Best Match:
CHEMBL2152285

L: Methotrimeprazine
NTRK1_HUMAN

Docking Scores:
-6.91 -7.05 -7.11
Similarity Score:
24.07%
Best Match:
CHEMBL1997617

L: Ketamine
NTRK1_HUMAN

Docking Scores:
-7.19 -7.14 -7.04
Similarity Score:
37.07%
Best Match:
CHEMBL1982413

L: Aspirin
OPRD_HUMAN

Docking Scores:
-5.82 -4.82 -5.15
Similarity Score:
34.75%
Best Match:
CHEMBL149074

L: Mesalazine
OPRD_HUMAN

Docking Scores:
-5.50 -4.67 -5.17
Similarity Score:
36.36%
Best Match:
CHEMBL416930

L: Sulfasalazine
OPRD_HUMAN

Docking Scores:
-7.42 -6.97 -7.42
Similarity Score:
29.41%
Best Match:
CHEMBL191987

L: Methotrimeprazine
OPRD_HUMAN

Docking Scores:
-6.36 -5.97 -5.91
Similarity Score:
38.95%
Best Match:
CHEMBL300662

L: Ketamine
OPRD_HUMAN

Docking Scores:
-6.90 -5.99 -6.72
Similarity Score:
54.74%
Best Match:
CHEMBL4062974

L: Aspirin
OPRK_HUMAN

Docking Scores:
-5.96 -6.23 -6.36
Similarity Score:
37.36%
Best Match:
CHEMBL942

L: Mesalazine
OPRK_HUMAN

Docking Scores:
-5.75 -5.72 -6.51
Similarity Score:
36.56%
Best Match:
CHEMBL283552

L: Sulfasalazine
OPRK_HUMAN

Docking Scores:
-8.85 -8.92 -9.45
Similarity Score:
33.74%
Best Match:
CHEMBL1713635

L: Methotrimeprazine
OPRK_HUMAN

Docking Scores:
-8.28 -8.04 -6.88
Similarity Score:
38.95%
Best Match:
CHEMBL300662

L: Ketamine
OPRK_HUMAN

Docking Scores:
-7.17 -7.64 -7.91
Similarity Score:
66.67%
Best Match:
CHEMBL512414

L: Aspirin
OPRM_MOUSE

Docking Scores:
-6.50 -5.50
Similarity Score:
28.97%
Best Match:
CHEMBL13470

L: Mesalazine
OPRM_MOUSE

Docking Scores:
-4.90 -5.24
Similarity Score:
36.56%
Best Match:
CHEMBL283552

L: Sulfasalazine
OPRM_MOUSE

Docking Scores:
-8.75 -9.00
Similarity Score:
24.27%
Best Match:
CHEMBL605510

L: Methotrimeprazine
OPRM_MOUSE

Docking Scores:
-7.06 -6.82
Similarity Score:
33.05%
Best Match:
CHEMBL440765

L: Ketamine
OPRM_MOUSE

Docking Scores:
-7.35 -6.82
Similarity Score:
48.15%
Best Match:
CHEMBL2017149