PSP case study #520 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Remdesivir
NA_A-H3N2

Docking Scores:
-7.59 -7.50
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NA_A-H3N2

Docking Scores:
-7.33 -7.42
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NA_A-H3N8

Docking Scores:
-8.37 -8.35 -8.09
Similarity Score:
19.35%
Best Match:
CHEMBL4278505

L: Remdesivir triphosphate
NA_A-H3N8

Docking Scores:
-8.24 -8.39 -8.24
Similarity Score:
17.22%
Best Match:
CHEMBL4285767

L: Remdesivir
NA_A-H5N1

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

L: Remdesivir triphosphate
NA_A-H5N1

Docking Scores:
-8.32
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NA_A-H7N9

Docking Scores:
-7.93 -8.03 -8.36
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NA_A-H7N9

Docking Scores:
-6.79 -7.81 -8.10
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NA_INFB

Docking Scores:
-7.83 -8.09
Similarity Score:
21.22%
Best Match:
CHEMBL362993

L: Remdesivir triphosphate
NA_INFB

Docking Scores:
-8.66 -7.47
Similarity Score:
22.34%
Best Match:
CHEMBL362993

L: Remdesivir
NP_9ADNV

Docking Scores:
-5.52 -7.87
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NP_9ADNV

Docking Scores:
-4.13 -7.58
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NP_A-H1N1

Docking Scores:
-5.82 -6.71 -6.08
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NP_A-H1N1

Docking Scores:
-5.50 -6.11 -6.13
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NP_A-H5N1

Docking Scores:
-5.92
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NP_A-H5N1

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

L: Remdesivir
NP_EBOZM

Docking Scores:
-6.25 -6.89 -6.23
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NP_EBOZM

Docking Scores:
-5.20 -6.42 -5.86
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NP_HCoV-NL63

Docking Scores:
-7.03
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
NP_HCoV-NL63

Docking Scores:
-6.18
Similarity Score:
N/A
Best Match:
N/A