Case-8.29.23 #513 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Remdesivir
ACE2_HUMAN

Docking Scores:
-10.03
Similarity Score:
27.45%
Best Match:
CHEMBL436639

L: Remdesivir Triphosphate
ACE2_HUMAN

Docking Scores:
-8.47
Similarity Score:
27.93%
Best Match:
CHEMBL436639

L: Remdesivir
CAPSD_9CALI

Docking Scores:
-7.69 -7.16 -8.30
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
CAPSD_9CALI

Docking Scores:
-6.96 -7.27 -7.70
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
CAPSD_9ENTO

Docking Scores:
-7.42
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
CAPSD_9ENTO

Docking Scores:
-8.56
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
CAPSD_DEN2P

Docking Scores:
-6.35
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
CAPSD_DEN2P

Docking Scores:
-5.77
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
CAPSD_HCV77

Docking Scores:
-5.24
Similarity Score:
50.17%
Best Match:
CHEMBL3696815

L: Remdesivir Triphosphate
CAPSD_HCV77

Docking Scores:
-4.39
Similarity Score:
33.85%
Best Match:
CHEMBL3696819

L: Remdesivir
CAPSD_HED68

Docking Scores:
-8.94 -9.98
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
CAPSD_HED68

Docking Scores:
-7.46 -8.47
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
CAPSD_ZIKV

Docking Scores:
-6.39 -6.55
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
CAPSD_ZIKV

Docking Scores:
-5.08 -4.88
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
DPM_HHV1K

Docking Scores:
-9.08
Similarity Score:
22.85%
Best Match:
CHEMBL479371

L: Remdesivir Triphosphate
DPM_HHV1K

Docking Scores:
-6.97
Similarity Score:
22.85%
Best Match:
CHEMBL479371

L: Remdesivir
E1_9HEPC

Docking Scores:
-5.85
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
E1_9HEPC

Docking Scores:
-5.33
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
E1_HCV77

Docking Scores:
-4.01
Similarity Score:
50.17%
Best Match:
CHEMBL3696815

L: Remdesivir Triphosphate
E1_HCV77

Docking Scores:
-3.39
Similarity Score:
33.85%
Best Match:
CHEMBL3696819