LTJv11 #87 Output Download CSV

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

Docking Scores:
-7.80 -8.21 -6.93
Similarity Score:
N/A
Best Match:
N/A

L: Lamivudine
NS3_HCV3A

Docking Scores:
-5.61 -5.84 -5.61
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NS3_HCV3A

Docking Scores:
-8.78 -8.83 -9.12
Similarity Score:
N/A
Best Match:
N/A

L: Delavirdine
NS3_HCV3A

Docking Scores:
-6.89 -7.06 -6.97
Similarity Score:
N/A
Best Match:
N/A

L: Atazanavir
NS3_HCV3A

Docking Scores:
-6.95 -6.24 -6.50
Similarity Score:
N/A
Best Match:
N/A

L: Indinavir
NS5B_HCV1A

Docking Scores:
-8.91 -10.26 -10.12
Similarity Score:
50.88%
Best Match:
CHEMBL13256

L: Lamivudine
NS5B_HCV1A

Docking Scores:
-6.30 -6.34 -6.32
Similarity Score:
20.49%
Best Match:
CHEMBL3644940

L: Paritaprevir
NS5B_HCV1A

Docking Scores:
-11.22 -11.31 -10.32
Similarity Score:
48.76%
Best Match:
CHEMBL3644934

L: Delavirdine
NS5B_HCV1A

Docking Scores:
-8.59 -9.15 -9.83
Similarity Score:
31.76%
Best Match:
CHEMBL3644907

L: Atazanavir
NS5B_HCV1A

Docking Scores:
-8.28 -9.45 -9.42
Similarity Score:
43.21%
Best Match:
CHEMBL353549

L: Indinavir
NS5B_HCV1B

Docking Scores:
-9.09 -9.12 -8.76
Similarity Score:
40.16%
Best Match:
CHEMBL3645200

L: Lamivudine
NS5B_HCV1B

Docking Scores:
-5.59 -5.82 -6.08
Similarity Score:
20.22%
Best Match:
CHEMBL3645211

L: Paritaprevir
NS5B_HCV1B

Docking Scores:
-10.71 -9.09 -8.62
Similarity Score:
39.44%
Best Match:
CHEMBL3645199

L: Delavirdine
NS5B_HCV1B

Docking Scores:
-8.39 -7.79 -7.50
Similarity Score:
42.79%
Best Match:
CHEMBL3645203

L: Atazanavir
NS5B_HCV1B

Docking Scores:
-8.27 -8.92 -8.44
Similarity Score:
36.65%
Best Match:
CHEMBL3422106

L: Indinavir
NS5B_HCV2A

Docking Scores:
-9.76 -7.10
Similarity Score:
N/A
Best Match:
N/A

L: Lamivudine
NS5B_HCV2A

Docking Scores:
-6.51 -6.80
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NS5B_HCV2A

Docking Scores:
-9.32 -5.12
Similarity Score:
N/A
Best Match:
N/A

L: Delavirdine
NS5B_HCV2A

Docking Scores:
-9.86 -9.54
Similarity Score:
N/A
Best Match:
N/A

L: Atazanavir
NS5B_HCV2A

Docking Scores:
-9.61 -6.02
Similarity Score:
N/A
Best Match:
N/A