Non anti-pain drug nv2 #224 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Hydrochlorothiazide
NMDE2_HUMAN

Docking Scores:
-7.16 -7.27 -7.27
Similarity Score:
16.13%
Best Match:
CHEMBL1779013

L: Dolutegravir
NMDE2_HUMAN

Docking Scores:
-10.79 -10.99 -10.05
Similarity Score:
38.93%
Best Match:
CHEMBL1779013

L: Metolazone
NMDE2_HUMAN

Docking Scores:
-8.89 -8.61 -9.29
Similarity Score:
31.28%
Best Match:
CHEMBL1779013

L: Bendroflumethiazide
NMDE2_HUMAN

Docking Scores:
-10.18 -10.31 -8.42
Similarity Score:
25.14%
Best Match:
CHEMBL444384

L: Hydralazine
NMDE2_HUMAN

Docking Scores:
-7.23 -6.73 -7.86
Similarity Score:
22.81%
Best Match:
CHEMBL2013202

L: Hydrochlorothiazide
NMDZ1_HUMAN

Docking Scores:
-7.41 -7.07 -7.33
Similarity Score:
33.52%
Best Match:
CHEMBL159739

L: Dolutegravir
NMDZ1_HUMAN

Docking Scores:
-9.69 -9.67 -9.08
Similarity Score:
37.87%
Best Match:
CHEMBL354003

L: Metolazone
NMDZ1_HUMAN

Docking Scores:
-8.17 -7.20 -7.36
Similarity Score:
43.20%
Best Match:
CHEMBL349729

L: Bendroflumethiazide
NMDZ1_HUMAN

Docking Scores:
-8.59 -8.82 -7.98
Similarity Score:
30.32%
Best Match:
CHEMBL159739

L: Hydralazine
NMDZ1_HUMAN

Docking Scores:
-7.54 -7.24 -7.71
Similarity Score:
16.31%
Best Match:
CHEMBL164231

L: Hydrochlorothiazide
NOS1_HUMAN

Docking Scores:
-7.72 -8.03 -7.58
Similarity Score:
25.21%
Best Match:
CHEMBL469352

L: Dolutegravir
NOS1_HUMAN

Docking Scores:
-10.55 -10.37 -9.86
Similarity Score:
38.57%
Best Match:
CHEMBL447183

L: Metolazone
NOS1_HUMAN

Docking Scores:
-9.09 -7.74 -8.98
Similarity Score:
38.66%
Best Match:
CHEMBL491897

L: Bendroflumethiazide
NOS1_HUMAN

Docking Scores:
-9.11 -9.59 -9.44
Similarity Score:
25.60%
Best Match:
CHEMBL3142587

L: Hydralazine
NOS1_HUMAN

Docking Scores:
-7.45 -7.68 -6.80
Similarity Score:
36.67%
Best Match:
CHEMBL479014

L: Hydrochlorothiazide
NOS2_HUMAN

Docking Scores:
-7.71 -7.41 -7.85
Similarity Score:
27.41%
Best Match:
CHEMBL490886

L: Dolutegravir
NOS2_HUMAN

Docking Scores:
-9.67 -9.95 -1.68
Similarity Score:
38.57%
Best Match:
CHEMBL447183

L: Metolazone
NOS2_HUMAN

Docking Scores:
-6.78 -7.92 -6.87
Similarity Score:
42.02%
Best Match:
CHEMBL522467

L: Bendroflumethiazide
NOS2_HUMAN

Docking Scores:
-8.91 -10.30 -8.01
Similarity Score:
31.52%
Best Match:
CHEMBL490886

L: Hydralazine
NOS2_HUMAN

Docking Scores:
-6.64 -6.56 -6.87
Similarity Score:
36.67%
Best Match:
CHEMBL479014