Non anti-pain drug v2 #218 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Captopril
PGH2_HUMAN

Docking Scores:
-5.09 -5.46 -5.53
Similarity Score:
53.03%
Best Match:
CHEMBL3809958

L: Fosinopril
PGH2_HUMAN

Docking Scores:
-2.11 -5.87 -7.09
Similarity Score:
35.16%
Best Match:
CHEMBL3809156

L: Lisinopril
PGH2_HUMAN

Docking Scores:
-6.10 -6.39 -6.72
Similarity Score:
73.96%
Best Match:
CHEMBL3809116

L: Ramipril
PGH2_HUMAN

Docking Scores:
-5.45 -6.08 -7.08
Similarity Score:
70.27%
Best Match:
CHEMBL3809156

L: Moexipril
PGH2_HUMAN

Docking Scores:
-2.19 -4.68 -7.19
Similarity Score:
56.29%
Best Match:
CHEMBL3809156

L: Captopril
PPAP_HUMAN

Docking Scores:
-6.10
Similarity Score:
10.00%
Best Match:
CHEMBL501717

L: Fosinopril
PPAP_HUMAN

Docking Scores:
-9.07
Similarity Score:
21.03%
Best Match:
CHEMBL507996

L: Lisinopril
PPAP_HUMAN

Docking Scores:
-7.50
Similarity Score:
21.77%
Best Match:
CHEMBL501717

L: Ramipril
PPAP_HUMAN

Docking Scores:
-7.61
Similarity Score:
20.44%
Best Match:
CHEMBL501717

L: Moexipril
PPAP_HUMAN

Docking Scores:
-7.35
Similarity Score:
29.89%
Best Match:
CHEMBL507996

L: Captopril
PPARG_HUMAN

Docking Scores:
-5.18 -5.35 -5.12
Similarity Score:
37.35%
Best Match:
CHEMBL1836976

L: Fosinopril
PPARG_HUMAN

Docking Scores:
-8.67 -8.94 -7.56
Similarity Score:
31.19%
Best Match:
CHEMBL2208197

L: Lisinopril
PPARG_HUMAN

Docking Scores:
-7.29 -8.05 -7.47
Similarity Score:
42.38%
Best Match:
CHEMBL2208197

L: Ramipril
PPARG_HUMAN

Docking Scores:
-7.57 -7.51 -7.31
Similarity Score:
41.94%
Best Match:
CHEMBL83875

L: Moexipril
PPARG_HUMAN

Docking Scores:
-8.19 -9.34 -8.21
Similarity Score:
48.63%
Best Match:
CHEMBL317424

L: Captopril
PRGR_HUMAN

Docking Scores:
-6.20 -6.26 -6.01
Similarity Score:
30.92%
Best Match:
CHEMBL436859

L: Fosinopril
PRGR_HUMAN

Docking Scores:
-2.95 -2.03 -7.37
Similarity Score:
33.78%
Best Match:
CHEMBL414318

L: Lisinopril
PRGR_HUMAN

Docking Scores:
-8.22 -7.54 -8.12
Similarity Score:
43.13%
Best Match:
CHEMBL436859

L: Ramipril
PRGR_HUMAN

Docking Scores:
-7.89 -7.66 -8.66
Similarity Score:
47.24%
Best Match:
CHEMBL414318

L: Moexipril
PRGR_HUMAN

Docking Scores:
-4.90 -3.09 -8.41
Similarity Score:
42.33%
Best Match:
CHEMBL1163975