Psp case study #507 Output Download CSV

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

Docking Scores:
-7.19 -7.01 -7.28
Similarity Score:
18.75%
Best Match:
CHEMBL2441745

L: Remdesivir triphosphate
PR_SARS

Docking Scores:
-5.76 -4.24 -5.87
Similarity Score:
17.54%
Best Match:
CHEMBL221366

L: Remdesivir
PR_SARS2

Docking Scores:
-7.99
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
PR_SARS2

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

L: Remdesivir
PR_TGEV

Docking Scores:
-7.35
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
PR_TGEV

Docking Scores:
0.69
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
P_9CALI

Docking Scores:
-7.55
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
P_9CALI

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

L: Remdesivir
P_NVN68

Docking Scores:
-5.90
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
P_NVN68

Docking Scores:
6.52
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
RDRP_SARS2

Docking Scores:
-6.24
Similarity Score:
100.00%
Best Match:
CHEMBL4065616

L: Remdesivir triphosphate
RDRP_SARS2

Docking Scores:
?
Similarity Score:
?
Best Match:
?

L: Remdesivir
RT_HIV1

Docking Scores:
-8.97 -9.30 -8.71
Similarity Score:
28.68%
Best Match:
CHEMBL4108778

L: Remdesivir triphosphate
RT_HIV1

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?

L: Remdesivir
SPIKE_HCoV-229E

Docking Scores:
-5.35
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
SPIKE_HCoV-229E

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

L: Remdesivir
SPIKE_HCoV-NL63

Docking Scores:
-4.96
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
SPIKE_HCoV-NL63

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

L: Remdesivir
SPIKE_HCoV-OC43

Docking Scores:
-7.52
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
SPIKE_HCoV-OC43

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