5 Drug Combinations #119 Output Download CSV

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

Docking Scores:
-9.34 -9.04 -7.87
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: Glimepiride
NS3_HCV3A

Docking Scores:
-7.61 -6.94 -7.67
Similarity Score:
N/A
Best Match:
N/A

L: Fedratinib
NS3_HCV3A

Docking Scores:
-7.42 -7.26 -7.17
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
NS3_HCV3A

Docking Scores:
-5.63 -5.35 -5.70
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS5B_HCV1A

Docking Scores:
-10.61 -9.96 -10.18
Similarity Score:
36.11%
Best Match:
CHEMBL3644880

L: Paritaprevir
NS5B_HCV1A

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

L: Glimepiride
NS5B_HCV1A

Docking Scores:
-9.38 -10.33 -10.10
Similarity Score:
41.28%
Best Match:
CHEMBL3644895

L: Fedratinib
NS5B_HCV1A

Docking Scores:
-8.30 -9.47 -9.02
Similarity Score:
27.93%
Best Match:
CHEMBL3644940

L: Oseltamivir
NS5B_HCV1A

Docking Scores:
-5.86 -6.56 -6.78
Similarity Score:
32.87%
Best Match:
CHEMBL13443

L: Bictegravir
NS5B_HCV1B

Docking Scores:
-9.58 -9.62 -8.92
Similarity Score:
36.31%
Best Match:
CHEMBL3645214

L: Paritaprevir
NS5B_HCV1B

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

L: Glimepiride
NS5B_HCV1B

Docking Scores:
-9.11 -8.99 -8.90
Similarity Score:
26.69%
Best Match:
CHEMBL3645210

L: Fedratinib
NS5B_HCV1B

Docking Scores:
-7.80 -8.28 -8.18
Similarity Score:
32.39%
Best Match:
CHEMBL3645179

L: Oseltamivir
NS5B_HCV1B

Docking Scores:
-6.32 -6.66 -6.64
Similarity Score:
22.18%
Best Match:
CHEMBL3645202

L: Bictegravir
NS5B_HCV2A

Docking Scores:
-11.00 -10.69
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: Glimepiride
NS5B_HCV2A

Docking Scores:
-10.11 -11.66
Similarity Score:
N/A
Best Match:
N/A

L: Fedratinib
NS5B_HCV2A

Docking Scores:
-10.48 -6.70
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
NS5B_HCV2A

Docking Scores:
-7.46 -7.49
Similarity Score:
N/A
Best Match:
N/A