Psp case study #507 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Remdesivir
NSP1_INFB

Docking Scores:
-6.23 -5.74
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP1_INFB

Docking Scores:
? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP1_SARS

Docking Scores:
-6.20
Similarity Score:
18.75%
Best Match:
CHEMBL2441745

L: Remdesivir triphosphate
NSP1_SARS

Docking Scores:
17.34
Similarity Score:
17.54%
Best Match:
CHEMBL221366

L: Remdesivir
NSP3_HCoV-229E

Docking Scores:
-8.41
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP3_HCoV-229E

Docking Scores:
14.40
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP3_IBV

Docking Scores:
-7.67
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP3_IBV

Docking Scores:
-3.24
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP3_MHV

Docking Scores:
-6.15
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP3_MHV

Docking Scores:
?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP3_SARS2

Docking Scores:
-7.34
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP3_SARS2

Docking Scores:
?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP9_HCoV-229E

Docking Scores:
-6.27 -6.75
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NSP9_HCoV-229E

Docking Scores:
? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PA_A-H17N10

Docking Scores:
-7.53
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
PA_A-H17N10

Docking Scores:
12.98
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PA_A-H1N1

Docking Scores:
-8.69 -7.82 -7.82
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
PA_A-H1N1

Docking Scores:
? ? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PA_A-H5N1

Docking Scores:
-8.76 -8.68 -8.58
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
PA_A-H5N1

Docking Scores:
8.56 0.66 6.35
Similarity Score:
N/A
Best Match:
N/A