anti-pain drug v1 #220 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Amitriptyline
NTRK1_HUMAN

Docking Scores:
-9.32 -9.47 -9.51
Similarity Score:
30.92%
Best Match:
CHEMBL175321

L: Tramadol
NTRK1_HUMAN

Docking Scores:
-7.16 -7.21 -7.18
Similarity Score:
35.29%
Best Match:
CHEMBL1992125

L: Ibuprofen
NTRK1_HUMAN

Docking Scores:
-7.78 -8.23 -8.00
Similarity Score:
23.85%
Best Match:
CHEMBL1978371

L: Fenbufen
NTRK1_HUMAN

Docking Scores:
-8.84 -8.98 -8.89
Similarity Score:
31.87%
Best Match:
CHEMBL1976290

L: Diclofenac
NTRK1_HUMAN

Docking Scores:
-8.08 -8.11 -8.12
Similarity Score:
46.43%
Best Match:
CHEMBL1991734

L: Amitriptyline
OPRD_HUMAN

Docking Scores:
-8.00 -7.77 -7.62
Similarity Score:
52.48%
Best Match:
CHEMBL126884

L: Tramadol
OPRD_HUMAN

Docking Scores:
-6.46 -5.71 -5.96
Similarity Score:
100.00%
Best Match:
CHEMBL1237044

L: Ibuprofen
OPRD_HUMAN

Docking Scores:
-6.63 -6.50 -6.30
Similarity Score:
38.46%
Best Match:
CHEMBL201038

L: Fenbufen
OPRD_HUMAN

Docking Scores:
-7.27 -6.72 -6.68
Similarity Score:
44.87%
Best Match:
CHEMBL126918

L: Diclofenac
OPRD_HUMAN

Docking Scores:
-7.03 -6.28 -7.00
Similarity Score:
39.26%
Best Match:
CHEMBL1642757

L: Amitriptyline
OPRK_HUMAN

Docking Scores:
-9.21 -9.69 -8.53
Similarity Score:
42.59%
Best Match:
CHEMBL126141

L: Tramadol
OPRK_HUMAN

Docking Scores:
-7.47 -7.43 -6.53
Similarity Score:
100.00%
Best Match:
CHEMBL1237044

L: Ibuprofen
OPRK_HUMAN

Docking Scores:
-7.68 -7.49 -6.96
Similarity Score:
42.86%
Best Match:
CHEMBL651

L: Fenbufen
OPRK_HUMAN

Docking Scores:
-8.29 -8.06 -8.69
Similarity Score:
54.43%
Best Match:
CHEMBL2022019

L: Diclofenac
OPRK_HUMAN

Docking Scores:
-8.51 -8.39 -7.73
Similarity Score:
39.26%
Best Match:
CHEMBL1642757

L: Amitriptyline
OPRM_MOUSE

Docking Scores:
-8.22 -8.62
Similarity Score:
39.66%
Best Match:
CHEMBL362331

L: Tramadol
OPRM_MOUSE

Docking Scores:
-7.61 -6.57
Similarity Score:
57.14%
Best Match:
CHEMBL592

L: Ibuprofen
OPRM_MOUSE

Docking Scores:
-6.47 -6.85
Similarity Score:
31.58%
Best Match:
CHEMBL151341

L: Fenbufen
OPRM_MOUSE

Docking Scores:
-7.99 -7.75
Similarity Score:
33.96%
Best Match:
CHEMBL71301

L: Diclofenac
OPRM_MOUSE

Docking Scores:
-7.68 -7.10
Similarity Score:
30.19%
Best Match:
CHEMBL596