Non anti-pain drug v2 #218 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Captopril
AA1R_HUMAN

Docking Scores:
-5.22 -5.15 -5.59
Similarity Score:
31.72%
Best Match:
CHEMBL3350613

L: Fosinopril
AA1R_HUMAN

Docking Scores:
-8.48 -8.97 -6.94
Similarity Score:
35.81%
Best Match:
CHEMBL3350613

L: Lisinopril
AA1R_HUMAN

Docking Scores:
-7.62 -7.85 -7.91
Similarity Score:
52.41%
Best Match:
CHEMBL3350613

L: Ramipril
AA1R_HUMAN

Docking Scores:
-7.99 -9.18 -6.83
Similarity Score:
58.78%
Best Match:
CHEMBL3350613

L: Moexipril
AA1R_HUMAN

Docking Scores:
-8.11 -9.03 -6.20
Similarity Score:
45.36%
Best Match:
CHEMBL3350613

L: Captopril
AA2AR_HUMAN

Docking Scores:
-5.14 -5.17 -5.76
Similarity Score:
31.72%
Best Match:
CHEMBL3350613

L: Fosinopril
AA2AR_HUMAN

Docking Scores:
-8.41 -8.88 -8.58
Similarity Score:
35.81%
Best Match:
CHEMBL3350613

L: Lisinopril
AA2AR_HUMAN

Docking Scores:
-7.29 -7.59 -8.13
Similarity Score:
52.41%
Best Match:
CHEMBL3350613

L: Ramipril
AA2AR_HUMAN

Docking Scores:
-7.91 -7.86 -8.98
Similarity Score:
58.78%
Best Match:
CHEMBL3350613

L: Moexipril
AA2AR_HUMAN

Docking Scores:
-8.16 -8.79 -7.99
Similarity Score:
46.19%
Best Match:
CHEMBL554840

L: Captopril
ACES_HUMAN

Docking Scores:
-6.59 -6.11 -6.26
Similarity Score:
49.44%
Best Match:
CHEMBL4078305

L: Fosinopril
ACES_HUMAN

Docking Scores:
-9.95 -9.72 -6.67
Similarity Score:
35.48%
Best Match:
CHEMBL1080631

L: Lisinopril
ACES_HUMAN

Docking Scores:
-8.88 -9.06 -9.18
Similarity Score:
52.34%
Best Match:
CHEMBL4078305

L: Ramipril
ACES_HUMAN

Docking Scores:
-10.09 -8.91 -8.51
Similarity Score:
56.00%
Best Match:
CHEMBL1080631

L: Moexipril
ACES_HUMAN

Docking Scores:
-9.99 -9.11 -7.91
Similarity Score:
54.60%
Best Match:
CHEMBL3262665

L: Captopril
ACE_HUMAN

Docking Scores:
-5.38 -5.55 -5.15
Similarity Score:
100.00%
Best Match:
CHEMBL1560

L: Fosinopril
ACE_HUMAN

Docking Scores:
-8.83 -8.96 -3.17
Similarity Score:
100.00%
Best Match:
CHEMBL3039598

L: Lisinopril
ACE_HUMAN

Docking Scores:
-6.97 -7.96 -7.24
Similarity Score:
100.00%
Best Match:
CHEMBL1237

L: Ramipril
ACE_HUMAN

Docking Scores:
-7.80 -8.69 -7.29
Similarity Score:
100.00%
Best Match:
CHEMBL1168

L: Moexipril
ACE_HUMAN

Docking Scores:
-8.60 -8.25 -7.35
Similarity Score:
100.00%
Best Match:
CHEMBL1165