LTJv15 #91 Output Download CSV

View All
 
  The docking scores are in the AutoDock Vina metric.
L: Zanamivir
NS3_HCV3A

Docking Scores:
-6.43 -6.53 -6.30
Similarity Score:
N/A
Best Match:
N/A

L: Ganciclovir
NS3_HCV3A

Docking Scores:
-5.80 -5.54 -6.24
Similarity Score:
N/A
Best Match:
N/A

L: Acyclovir
NS3_HCV3A

Docking Scores:
-5.56 -5.94 -5.79
Similarity Score:
N/A
Best Match:
N/A

L: Entecavir
NS3_HCV3A

Docking Scores:
-6.76 -6.69 -6.73
Similarity Score:
N/A
Best Match:
N/A

L: Trifluridine
NS3_HCV3A

Docking Scores:
-6.98 -6.89 -6.44
Similarity Score:
N/A
Best Match:
N/A

L: Zanamivir
NS5B_HCV1A

Docking Scores:
-6.40 -6.84 -6.78
Similarity Score:
26.37%
Best Match:
CHEMBL163917

L: Ganciclovir
NS5B_HCV1A

Docking Scores:
-6.38 -6.34 -6.29
Similarity Score:
23.28%
Best Match:
CHEMBL353549

L: Acyclovir
NS5B_HCV1A

Docking Scores:
-6.45 -6.17 -6.00
Similarity Score:
22.94%
Best Match:
CHEMBL353549

L: Entecavir
NS5B_HCV1A

Docking Scores:
-7.46 -7.43 -7.45
Similarity Score:
27.43%
Best Match:
CHEMBL353549

L: Trifluridine
NS5B_HCV1A

Docking Scores:
-7.34 -7.07 -7.05
Similarity Score:
23.65%
Best Match:
CHEMBL353549

L: Zanamivir
NS5B_HCV1B

Docking Scores:
-6.78 -6.98 -6.28
Similarity Score:
20.83%
Best Match:
CHEMBL3645214

L: Ganciclovir
NS5B_HCV1B

Docking Scores:
-6.02 -6.40 -6.21
Similarity Score:
22.53%
Best Match:
CHEMBL3645211

L: Acyclovir
NS5B_HCV1B

Docking Scores:
-5.92 -6.17 -6.07
Similarity Score:
21.74%
Best Match:
CHEMBL3645211

L: Entecavir
NS5B_HCV1B

Docking Scores:
-6.93 -6.86 -6.55
Similarity Score:
24.51%
Best Match:
CHEMBL3645202

L: Trifluridine
NS5B_HCV1B

Docking Scores:
-7.32 -7.21 -7.40
Similarity Score:
21.51%
Best Match:
CHEMBL3645211

L: Zanamivir
NS5B_HCV2A

Docking Scores:
-7.32 -6.53
Similarity Score:
N/A
Best Match:
N/A

L: Ganciclovir
NS5B_HCV2A

Docking Scores:
-7.00 -6.97
Similarity Score:
N/A
Best Match:
N/A

L: Acyclovir
NS5B_HCV2A

Docking Scores:
-6.33 -6.67
Similarity Score:
N/A
Best Match:
N/A

L: Entecavir
NS5B_HCV2A

Docking Scores:
-7.90 -8.10
Similarity Score:
N/A
Best Match:
N/A

L: Trifluridine
NS5B_HCV2A

Docking Scores:
-7.97 -8.21
Similarity Score:
N/A
Best Match:
N/A