Case-8.29.23 #513 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Remdesivir
PR_FCoV

Docking Scores:
-7.51
Similarity Score:
18.65%
Best Match:
CHEMBL4214471

L: Remdesivir Triphosphate
PR_FCoV

Docking Scores:
-7.30
Similarity Score:
19.38%
Best Match:
CHEMBL4214471

L: Remdesivir
PR_HCoV-229E

Docking Scores:
-7.38 -6.56
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_HCoV-229E

Docking Scores:
-6.88 -6.47
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_HCoV-NL63

Docking Scores:
-4.63 -7.74
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_HCoV-NL63

Docking Scores:
-4.80 -6.84
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_HIV1

Docking Scores:
-6.62 -7.13 -6.53
Similarity Score:
22.62%
Best Match:
CHEMBL3645127

L: Remdesivir Triphosphate
PR_HIV1

Docking Scores:
-6.30 -6.47 -5.91
Similarity Score:
24.48%
Best Match:
CHEMBL510485

L: Remdesivir
PR_HIV2

Docking Scores:
-6.85 -6.45
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_HIV2

Docking Scores:
-6.69 -6.17
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_HKU1

Docking Scores:
-6.98
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_HKU1

Docking Scores:
-6.73
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_HKU4

Docking Scores:
-6.74 -6.94 -7.02
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_HKU4

Docking Scores:
-6.55 -6.43 -6.10
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_IBV

Docking Scores:
-7.62
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_IBV

Docking Scores:
-6.84
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_MERs

Docking Scores:
-7.37 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_MERs

Docking Scores:
-6.42 -7.14
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
PR_PEDV

Docking Scores:
-7.62
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
PR_PEDV

Docking Scores:
-7.00
Similarity Score:
N/A
Best Match:
N/A