Psp case study #507 Output Download CSV

 
  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:
?
Similarity Score:
?
Best Match:
?

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:
? ? ?
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:
?
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:
-2.69
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:
-2.97
Similarity Score:
27.72%
Best Match:
CHEMBL3913754

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:
? ?
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:
0.73 1.95
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:
?
Similarity Score:
?
Best Match:
?

L: Remdesivir
E1_9HEPC

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

L: Remdesivir triphosphate
E1_9HEPC

Docking Scores:
?
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:
-2.97
Similarity Score:
27.72%
Best Match:
CHEMBL3913754