Drug combination for HCV treatment #387 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Sofosbuvir
3C_HE71

Docking Scores:
-6.36 -6.97
Similarity Score:
N/A
Best Match:
N/A

L: Brequinar
3C_HED68

Docking Scores:
-6.75
Similarity Score:
N/A
Best Match:
N/A

L: Niclosamide
3C_HED68

Docking Scores:
-6.00
Similarity Score:
N/A
Best Match:
N/A

L: Sofosbuvir
3C_HED68

Docking Scores:
-6.12
Similarity Score:
N/A
Best Match:
N/A

L: Brequinar
3D_HE71

Docking Scores:
-9.25
Similarity Score:
N/A
Best Match:
N/A

L: Niclosamide
3D_HE71

Docking Scores:
-7.72
Similarity Score:
N/A
Best Match:
N/A

L: Sofosbuvir
3D_HE71

Docking Scores:
-7.94
Similarity Score:
N/A
Best Match:
N/A

L: Brequinar
3D_HED68

Docking Scores:
-10.13
Similarity Score:
N/A
Best Match:
N/A

L: Niclosamide
3D_HED68

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

L: Sofosbuvir
3D_HED68

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

L: Brequinar
ACE2_HUMAN

Docking Scores:
-10.53
Similarity Score:
23.63%
Best Match:
CHEMBL1240682

L: Niclosamide
ACE2_HUMAN

Docking Scores:
-8.90
Similarity Score:
21.83%
Best Match:
CHEMBL253224

L: Sofosbuvir
ACE2_HUMAN

Docking Scores:
-9.47
Similarity Score:
21.52%
Best Match:
CHEMBL1240682

L: Brequinar
CAPSD_9CALI

Docking Scores:
-9.11 -8.12 -9.30
Similarity Score:
N/A
Best Match:
N/A

L: Niclosamide
CAPSD_9CALI

Docking Scores:
-7.59 -6.94 -8.45
Similarity Score:
N/A
Best Match:
N/A

L: Sofosbuvir
CAPSD_9CALI

Docking Scores:
-8.75 -7.52 -7.95
Similarity Score:
N/A
Best Match:
N/A

L: Brequinar
CAPSD_9ENTO

Docking Scores:
-12.66
Similarity Score:
N/A
Best Match:
N/A

L: Niclosamide
CAPSD_9ENTO

Docking Scores:
-10.19
Similarity Score:
N/A
Best Match:
N/A

L: Sofosbuvir
CAPSD_9ENTO

Docking Scores:
-9.33
Similarity Score:
N/A
Best Match:
N/A

L: Brequinar
CAPSD_DEN2P

Docking Scores:
-9.22
Similarity Score:
N/A
Best Match:
N/A