Non anti-pain drug nv2 #224 Output Download CSV

View All
 
  The docking scores are in the AutoDock Vina metric.
L: Hydrochlorothiazide
DRD4_HUMAN

Docking Scores:
-8.06 -8.13
Similarity Score:
38.57%
Best Match:
CHEMBL195247

L: Dolutegravir
DRD4_HUMAN

Docking Scores:
-11.13 -11.15
Similarity Score:
39.60%
Best Match:
CHEMBL1627311

L: Metolazone
DRD4_HUMAN

Docking Scores:
-9.29 -9.25
Similarity Score:
51.43%
Best Match:
CHEMBL106917

L: Bendroflumethiazide
DRD4_HUMAN

Docking Scores:
-10.07 -10.41
Similarity Score:
38.46%
Best Match:
CHEMBL106917

L: Hydralazine
DRD4_HUMAN

Docking Scores:
-7.51 -7.67
Similarity Score:
30.39%
Best Match:
CHEMBL273860

L: Hydrochlorothiazide
EDN1_HUMAN

Docking Scores:
-6.57
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
EDN1_HUMAN

Docking Scores:
-9.99
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
EDN1_HUMAN

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

L: Bendroflumethiazide
EDN1_HUMAN

Docking Scores:
-9.28
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
EDN1_HUMAN

Docking Scores:
-6.94
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
ESR1_HUMAN

Docking Scores:
-7.40 -7.38 -7.24
Similarity Score:
39.85%
Best Match:
CHEMBL264655

L: Dolutegravir
ESR1_HUMAN

Docking Scores:
-8.72 -10.00 -9.04
Similarity Score:
35.42%
Best Match:
CHEMBL3925390

L: Metolazone
ESR1_HUMAN

Docking Scores:
-6.48 -8.47 -8.00
Similarity Score:
37.58%
Best Match:
CHEMBL242818

L: Bendroflumethiazide
ESR1_HUMAN

Docking Scores:
-7.34 -8.06 -8.07
Similarity Score:
45.00%
Best Match:
CHEMBL378581

L: Hydralazine
ESR1_HUMAN

Docking Scores:
-7.19 -6.73 -6.46
Similarity Score:
34.52%
Best Match:
CHEMBL223026

L: Hydrochlorothiazide
FABP5_HUMAN

Docking Scores:
-6.94 -5.70 -5.65
Similarity Score:
20.32%
Best Match:
CHEMBL3941588

L: Dolutegravir
FABP5_HUMAN

Docking Scores:
-7.59 -7.28 -7.70
Similarity Score:
27.34%
Best Match:
CHEMBL3950316

L: Metolazone
FABP5_HUMAN

Docking Scores:
-8.38 -6.58 -7.06
Similarity Score:
31.84%
Best Match:
CHEMBL3941588

L: Bendroflumethiazide
FABP5_HUMAN

Docking Scores:
-9.35 -6.71 -6.47
Similarity Score:
21.62%
Best Match:
CHEMBL3941588

L: Hydralazine
FABP5_HUMAN

Docking Scores:
-6.45 -5.18 -5.67
Similarity Score:
17.88%
Best Match:
CHEMBL3941588