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
HPGDS_HUMAN

Docking Scores:
-6.04 -6.12 -7.11
Similarity Score:
33.33%
Best Match:
CHEMBL2035654

L: Mesalazine
HPGDS_HUMAN

Docking Scores:
-5.56 -6.08 -6.46
Similarity Score:
30.77%
Best Match:
CHEMBL2035654

L: Sulfasalazine
HPGDS_HUMAN

Docking Scores:
-8.84 -8.80 -9.25
Similarity Score:
27.18%
Best Match:
CHEMBL3934642

L: Methotrimeprazine
HPGDS_HUMAN

Docking Scores:
-6.34 -5.35 -5.43
Similarity Score:
20.69%
Best Match:
CHEMBL3698278

L: Ketamine
HPGDS_HUMAN

Docking Scores:
-7.01 -5.36 -5.45
Similarity Score:
26.39%
Best Match:
CHEMBL3650224

L: Aspirin
HRH1_HUMAN

Docking Scores:
-7.17
Similarity Score:
38.46%
Best Match:
CHEMBL2158833

L: Mesalazine
HRH1_HUMAN

Docking Scores:
-6.60
Similarity Score:
39.81%
Best Match:
CHEMBL2158823

L: Sulfasalazine
HRH1_HUMAN

Docking Scores:
-10.76
Similarity Score:
35.78%
Best Match:
CHEMBL1077908

L: Methotrimeprazine
HRH1_HUMAN

Docking Scores:
-5.66
Similarity Score:
36.54%
Best Match:
CHEMBL1201203

L: Ketamine
HRH1_HUMAN

Docking Scores:
-7.69
Similarity Score:
51.49%
Best Match:
CHEMBL3818047

L: Aspirin
HYES_HUMAN

Docking Scores:
-6.41 -6.70 -6.36
Similarity Score:
47.92%
Best Match:
CHEMBL244407

L: Mesalazine
HYES_HUMAN

Docking Scores:
-6.19 -5.95 -6.21
Similarity Score:
47.83%
Best Match:
CHEMBL477046

L: Sulfasalazine
HYES_HUMAN

Docking Scores:
-10.43 -9.66 -9.50
Similarity Score:
39.31%
Best Match:
CHEMBL2392745

L: Methotrimeprazine
HYES_HUMAN

Docking Scores:
-7.00 -6.97 -7.15
Similarity Score:
38.00%
Best Match:
CHEMBL561665

L: Ketamine
HYES_HUMAN

Docking Scores:
-7.51 -7.09 -6.06
Similarity Score:
53.19%
Best Match:
CHEMBL1933676

L: Aspirin
IKKB_HUMAN

Docking Scores:
-6.20
Similarity Score:
32.98%
Best Match:
CHEMBL3318321

L: Mesalazine
IKKB_HUMAN

Docking Scores:
-6.03
Similarity Score:
37.50%
Best Match:
CHEMBL504261

L: Sulfasalazine
IKKB_HUMAN

Docking Scores:
-8.44
Similarity Score:
39.22%
Best Match:
CHEMBL473080

L: Methotrimeprazine
IKKB_HUMAN

Docking Scores:
-6.91
Similarity Score:
33.95%
Best Match:
CHEMBL1672879

L: Ketamine
IKKB_HUMAN

Docking Scores:
-6.34
Similarity Score:
32.41%
Best Match:
CHEMBL3318321