Five Non-analgesic Drugs #227 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Omeprazole
ACHA9_HUMAN

Docking Scores:
-6.73
Similarity Score:
19.83%
Best Match:
CHEMBL386114

L: Hydrochlorothiazide
ACHA9_HUMAN

Docking Scores:
-6.63
Similarity Score:
14.61%
Best Match:
CHEMBL386114

L: Chlorpropamide
ACHA9_HUMAN

Docking Scores:
-5.63
Similarity Score:
15.90%
Best Match:
CHEMBL386114

L: Oseltamivir
ACHA9_HUMAN

Docking Scores:
-5.63
Similarity Score:
23.61%
Best Match:
CHEMBL386114

L: Hydralazine
ACHA9_HUMAN

Docking Scores:
-5.94
Similarity Score:
12.09%
Best Match:
CHEMBL386114

L: Omeprazole
ACHB2_HUMAN

Docking Scores:
-7.06 -7.77 -5.98
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
ACHB2_HUMAN

Docking Scores:
-5.17 -7.39 -7.13
Similarity Score:
N/A
Best Match:
N/A

L: Chlorpropamide
ACHB2_HUMAN

Docking Scores:
-7.35 -7.37 -7.81
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
ACHB2_HUMAN

Docking Scores:
-5.80 -5.54 -5.97
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
ACHB2_HUMAN

Docking Scores:
-6.39 -7.02 -7.20
Similarity Score:
N/A
Best Match:
N/A

L: Omeprazole
ACM1_HUMAN

Docking Scores:
-7.94 -3.50
Similarity Score:
34.74%
Best Match:
CHEMBL1935444

L: Hydrochlorothiazide
ACM1_HUMAN

Docking Scores:
-8.69 -4.84
Similarity Score:
35.00%
Best Match:
CHEMBL2057767

L: Chlorpropamide
ACM1_HUMAN

Docking Scores:
-7.51 -6.98
Similarity Score:
39.13%
Best Match:
CHEMBL179993

L: Oseltamivir
ACM1_HUMAN

Docking Scores:
-7.61 -6.78
Similarity Score:
46.92%
Best Match:
CHEMBL182761

L: Hydralazine
ACM1_HUMAN

Docking Scores:
-7.12 -6.85
Similarity Score:
29.91%
Best Match:
CHEMBL3360955

L: Omeprazole
ACM4_HUMAN

Docking Scores:
-7.78 -8.27
Similarity Score:
31.58%
Best Match:
CHEMBL59939

L: Hydrochlorothiazide
ACM4_HUMAN

Docking Scores:
-8.43 -6.99
Similarity Score:
33.74%
Best Match:
CHEMBL4082397

L: Chlorpropamide
ACM4_HUMAN

Docking Scores:
-7.68 -7.00
Similarity Score:
38.39%
Best Match:
CHEMBL1455766

L: Oseltamivir
ACM4_HUMAN

Docking Scores:
-7.64 -6.90
Similarity Score:
44.35%
Best Match:
CHEMBL313738

L: Hydralazine
ACM4_HUMAN

Docking Scores:
-7.26 -7.11
Similarity Score:
25.49%
Best Match:
CHEMBL7568