Non anti-pain drug v2 #218 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Captopril
PDE4B_HUMAN

Docking Scores:
-5.69 -5.93 -5.54
Similarity Score:
27.64%
Best Match:
CHEMBL144499

L: Fosinopril
PDE4B_HUMAN

Docking Scores:
-8.61 -8.28 -8.78
Similarity Score:
33.68%
Best Match:
CHEMBL144499

L: Lisinopril
PDE4B_HUMAN

Docking Scores:
-8.16 -8.61 -8.51
Similarity Score:
47.24%
Best Match:
CHEMBL144499

L: Ramipril
PDE4B_HUMAN

Docking Scores:
-8.43 -8.59 -8.76
Similarity Score:
47.79%
Best Match:
CHEMBL144499

L: Moexipril
PDE4B_HUMAN

Docking Scores:
-8.56 -9.70 -8.96
Similarity Score:
62.15%
Best Match:
CHEMBL4076662

L: Captopril
PDE5A_HUMAN

Docking Scores:
-5.66 -6.08 -5.77
Similarity Score:
25.95%
Best Match:
CHEMBL190423

L: Fosinopril
PDE5A_HUMAN

Docking Scores:
-8.68 -9.97 -8.74
Similarity Score:
29.13%
Best Match:
CHEMBL190423

L: Lisinopril
PDE5A_HUMAN

Docking Scores:
-8.19 -8.53 -7.60
Similarity Score:
37.32%
Best Match:
CHEMBL190423

L: Ramipril
PDE5A_HUMAN

Docking Scores:
-7.96 -8.73 -8.46
Similarity Score:
35.71%
Best Match:
CHEMBL190423

L: Moexipril
PDE5A_HUMAN

Docking Scores:
-8.09 -8.95 -8.43
Similarity Score:
56.76%
Best Match:
CHEMBL30936

L: Captopril
PERM_HUMAN

Docking Scores:
-5.09 -5.25 -5.01
Similarity Score:
23.08%
Best Match:
CHEMBL2347029

L: Fosinopril
PERM_HUMAN

Docking Scores:
-8.63 -8.77 -7.94
Similarity Score:
26.29%
Best Match:
CHEMBL2347029

L: Lisinopril
PERM_HUMAN

Docking Scores:
-7.95 -8.10 -7.50
Similarity Score:
38.10%
Best Match:
CHEMBL2347029

L: Ramipril
PERM_HUMAN

Docking Scores:
-8.29 -8.55 -7.83
Similarity Score:
35.25%
Best Match:
CHEMBL2347029

L: Moexipril
PERM_HUMAN

Docking Scores:
-8.10 -7.97 -7.87
Similarity Score:
33.33%
Best Match:
CHEMBL3899797

L: Captopril
PGH1_SHEEP

Docking Scores:
-5.78 -6.34 -5.58
Similarity Score:
39.05%
Best Match:
CHEMBL3809863

L: Fosinopril
PGH1_SHEEP

Docking Scores:
-5.52 -6.85 -6.20
Similarity Score:
30.00%
Best Match:
CHEMBL3809863

L: Lisinopril
PGH1_SHEEP

Docking Scores:
-8.14 -7.55 -7.49
Similarity Score:
54.39%
Best Match:
CHEMBL3809863

L: Ramipril
PGH1_SHEEP

Docking Scores:
-7.54 -8.86 -6.61
Similarity Score:
49.61%
Best Match:
CHEMBL3809863

L: Moexipril
PGH1_SHEEP

Docking Scores:
-6.21 -7.29 -8.04
Similarity Score:
42.03%
Best Match:
CHEMBL24798