SARS2v2 #172 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Digoxin
NS3_HCV3A

Docking Scores:
-8.90 -8.76 -8.62
Similarity Score:
N/A
Best Match:
N/A

L: Hexachlorophene
NS3_HCV3A

Docking Scores:
-6.45 -6.32 -6.06
Similarity Score:
N/A
Best Match:
N/A

L: Digitoxin
NS3_HCV3A

Docking Scores:
-8.63 -8.31 -7.76
Similarity Score:
N/A
Best Match:
N/A

L: Proscillaridin
NS3_HCV3A

Docking Scores:
-8.30 -8.17 -8.25
Similarity Score:
N/A
Best Match:
N/A

L: Hydroxyprogesterone caproate
NS3_HCV3A

Docking Scores:
-7.48 -6.74 -7.14
Similarity Score:
N/A
Best Match:
N/A

L: Digoxin
NS5B_HCV1A

Docking Scores:
-10.39 -10.91 -10.22
Similarity Score:
18.14%
Best Match:
CHEMBL3644879

L: Hexachlorophene
NS5B_HCV1A

Docking Scores:
-6.93 -7.47 -7.23
Similarity Score:
27.43%
Best Match:
CHEMBL178973

L: Digitoxin
NS5B_HCV1A

Docking Scores:
-9.86 -11.30 -10.96
Similarity Score:
18.14%
Best Match:
CHEMBL3644879

L: Proscillaridin
NS5B_HCV1A

Docking Scores:
-10.57 -10.65 -10.74
Similarity Score:
20.31%
Best Match:
CHEMBL353549

L: Hydroxyprogesterone caproate
NS5B_HCV1A

Docking Scores:
-7.61 -8.37 -8.40
Similarity Score:
21.49%
Best Match:
CHEMBL320324

L: Digoxin
NS5B_HCV1B

Docking Scores:
-9.65 -8.38 -7.82
Similarity Score:
18.11%
Best Match:
CHEMBL3970609

L: Hexachlorophene
NS5B_HCV1B

Docking Scores:
-7.54 -6.71 -6.52
Similarity Score:
16.92%
Best Match:
CHEMBL3645194

L: Digitoxin
NS5B_HCV1B

Docking Scores:
-8.72 -8.37 -8.11
Similarity Score:
18.11%
Best Match:
CHEMBL3970609

L: Proscillaridin
NS5B_HCV1B

Docking Scores:
-9.59 -9.40 -9.07
Similarity Score:
22.38%
Best Match:
CHEMBL3970609

L: Hydroxyprogesterone caproate
NS5B_HCV1B

Docking Scores:
-8.36 -8.27 -7.66
Similarity Score:
14.29%
Best Match:
CHEMBL3645202

L: Digoxin
NS5B_HCV2A

Docking Scores:
-9.84 -7.03
Similarity Score:
N/A
Best Match:
N/A

L: Hexachlorophene
NS5B_HCV2A

Docking Scores:
-8.43 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Digitoxin
NS5B_HCV2A

Docking Scores:
-10.21 -6.47
Similarity Score:
N/A
Best Match:
N/A

L: Proscillaridin
NS5B_HCV2A

Docking Scores:
-9.69 -8.02
Similarity Score:
N/A
Best Match:
N/A

L: Hydroxyprogesterone caproate
NS5B_HCV2A

Docking Scores:
-8.30 -8.10
Similarity Score:
N/A
Best Match:
N/A