Non anti-pain drug v2 #218 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Captopril
AOFA_HUMAN

Docking Scores:
-6.27 -6.11 -6.44
Similarity Score:
24.47%
Best Match:
CHEMBL3415788

L: Fosinopril
AOFA_HUMAN

Docking Scores:
-9.60 -9.31 -6.78
Similarity Score:
26.07%
Best Match:
CHEMBL4073457

L: Lisinopril
AOFA_HUMAN

Docking Scores:
-8.32 -8.86 -8.51
Similarity Score:
43.33%
Best Match:
CHEMBL3330339

L: Ramipril
AOFA_HUMAN

Docking Scores:
-9.72 -9.23 -8.42
Similarity Score:
38.41%
Best Match:
CHEMBL4073457

L: Moexipril
AOFA_HUMAN

Docking Scores:
-10.65 -10.17 -9.05
Similarity Score:
42.07%
Best Match:
CHEMBL1813520

L: Captopril
AOFB_HUMAN

Docking Scores:
-6.67 -6.59 -6.60
Similarity Score:
24.47%
Best Match:
CHEMBL3415788

L: Fosinopril
AOFB_HUMAN

Docking Scores:
-9.18 -7.74 -8.07
Similarity Score:
27.83%
Best Match:
CHEMBL4067432

L: Lisinopril
AOFB_HUMAN

Docking Scores:
-9.00 -8.11 -8.86
Similarity Score:
43.33%
Best Match:
CHEMBL3330339

L: Ramipril
AOFB_HUMAN

Docking Scores:
-8.96 -8.52 -8.47
Similarity Score:
37.50%
Best Match:
CHEMBL3330339

L: Moexipril
AOFB_HUMAN

Docking Scores:
-10.01 -10.60 -9.56
Similarity Score:
42.07%
Best Match:
CHEMBL1813520

L: Captopril
BACE1_HUMAN

Docking Scores:
-4.95 -5.04 -5.59
Similarity Score:
60.27%
Best Match:
CHEMBL461602

L: Fosinopril
BACE1_HUMAN

Docking Scores:
-7.23 -7.63 -7.79
Similarity Score:
41.41%
Best Match:
CHEMBL556143

L: Lisinopril
BACE1_HUMAN

Docking Scores:
-6.67 -6.83 -7.31
Similarity Score:
86.02%
Best Match:
CHEMBL1917900

L: Ramipril
BACE1_HUMAN

Docking Scores:
-6.98 -7.44 -7.96
Similarity Score:
74.77%
Best Match:
CHEMBL1917900

L: Moexipril
BACE1_HUMAN

Docking Scores:
-6.50 -7.39 -7.54
Similarity Score:
63.33%
Best Match:
CHEMBL1917907

L: Captopril
CAH2_HUMAN

Docking Scores:
-5.96 -5.92 -5.53
Similarity Score:
59.42%
Best Match:
CHEMBL2023730

L: Fosinopril
CAH2_HUMAN

Docking Scores:
-7.58 -8.01 -7.82
Similarity Score:
40.20%
Best Match:
CHEMBL4059816

L: Lisinopril
CAH2_HUMAN

Docking Scores:
-7.07 -7.72 -7.41
Similarity Score:
54.05%
Best Match:
CHEMBL3314178

L: Ramipril
CAH2_HUMAN

Docking Scores:
-8.05 -8.22 -7.82
Similarity Score:
59.03%
Best Match:
CHEMBL4059816

L: Moexipril
CAH2_HUMAN

Docking Scores:
-7.94 -8.56 -8.28
Similarity Score:
57.54%
Best Match:
CHEMBL4067116