Five Non-analgesic Drugs #229 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Omeprazole
AA1R_HUMAN

Docking Scores:
-7.69 -7.91 -8.26
Similarity Score:
38.16%
Best Match:
CHEMBL125979

L: Metolazone
AA1R_HUMAN

Docking Scores:
-7.99 -8.35 -8.64
Similarity Score:
36.73%
Best Match:
CHEMBL608980

L: Metformin
AA1R_HUMAN

Docking Scores:
-4.63 -4.32 -5.19
Similarity Score:
6.48%
Best Match:
CHEMBL329774

L: Oseltamivir
AA1R_HUMAN

Docking Scores:
-7.13 -6.88 -6.86
Similarity Score:
33.02%
Best Match:
CHEMBL608220

L: Miglitol
AA1R_HUMAN

Docking Scores:
-4.81 -5.00 -5.27
Similarity Score:
26.52%
Best Match:
CHEMBL3770601

L: Omeprazole
AA2AR_HUMAN

Docking Scores:
-7.86 -7.78 -8.43
Similarity Score:
38.16%
Best Match:
CHEMBL125979

L: Metolazone
AA2AR_HUMAN

Docking Scores:
-7.88 -7.57 -9.77
Similarity Score:
36.73%
Best Match:
CHEMBL608980

L: Metformin
AA2AR_HUMAN

Docking Scores:
-4.84 -5.03 -5.13
Similarity Score:
8.91%
Best Match:
CHEMBL1099100

L: Oseltamivir
AA2AR_HUMAN

Docking Scores:
-6.49 -6.90 -7.69
Similarity Score:
32.97%
Best Match:
CHEMBL3350613

L: Miglitol
AA2AR_HUMAN

Docking Scores:
-4.66 -4.87 -5.18
Similarity Score:
26.52%
Best Match:
CHEMBL3770601

L: Omeprazole
ACES_HUMAN

Docking Scores:
-9.48 -8.83 -9.58
Similarity Score:
35.53%
Best Match:
CHEMBL374729

L: Metolazone
ACES_HUMAN

Docking Scores:
-10.28 -9.49 -8.28
Similarity Score:
49.01%
Best Match:
CHEMBL141810

L: Metformin
ACES_HUMAN

Docking Scores:
-5.86 -5.55 -5.68
Similarity Score:
18.52%
Best Match:
CHEMBL1956097

L: Oseltamivir
ACES_HUMAN

Docking Scores:
-7.98 -7.76 -8.43
Similarity Score:
43.06%
Best Match:
CHEMBL1080631

L: Miglitol
ACES_HUMAN

Docking Scores:
-6.09 -6.02 -5.88
Similarity Score:
46.51%
Best Match:
CHEMBL345241

L: Omeprazole
ACE_HUMAN

Docking Scores:
-8.51 -8.76 -7.09
Similarity Score:
34.00%
Best Match:
CHEMBL3414814

L: Metolazone
ACE_HUMAN

Docking Scores:
-8.65 -8.34 -8.09
Similarity Score:
33.52%
Best Match:
CHEMBL2435340

L: Metformin
ACE_HUMAN

Docking Scores:
-5.50 -5.79 -5.21
Similarity Score:
5.49%
Best Match:
CHEMBL101360

L: Oseltamivir
ACE_HUMAN

Docking Scores:
-7.17 -7.02 -6.23
Similarity Score:
48.03%
Best Match:
CHEMBL1581

L: Miglitol
ACE_HUMAN

Docking Scores:
-5.77 -5.21 -5.04
Similarity Score:
44.12%
Best Match:
CHEMBL331575