LTJv7 #83 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Bictegravir
NP_INFD

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

L: Darunavir
NP_INFD

Docking Scores:
-5.36
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NP_INFD

Docking Scores:
-5.32
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NP_INFD

Docking Scores:
-6.04
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NP_INFD

Docking Scores:
-4.95
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NP_SARS

Docking Scores:
-9.04
Similarity Score:
N/A
Best Match:
N/A

L: Darunavir
NP_SARS

Docking Scores:
-7.91
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NP_SARS

Docking Scores:
-8.33
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NP_SARS

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

L: Adefovir dipivoxil
NP_SARS

Docking Scores:
-6.41
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS3_HCV1A

Docking Scores:
-7.77 -7.76 -9.84
Similarity Score:
37.41%
Best Match:
CHEMBL3645743

L: Darunavir
NS3_HCV1A

Docking Scores:
-5.68 -6.08 -6.69
Similarity Score:
27.85%
Best Match:
CHEMBL3639445

L: Baloxavir marboxil
NS3_HCV1A

Docking Scores:
-7.22 -7.01 -6.56
Similarity Score:
33.49%
Best Match:
CHEMBL3896463

L: Simeprevir
NS3_HCV1A

Docking Scores:
-8.65 -6.74 -7.62
Similarity Score:
41.64%
Best Match:
CHEMBL3645743

L: Adefovir dipivoxil
NS3_HCV1A

Docking Scores:
-5.68 -5.23 -5.95
Similarity Score:
33.62%
Best Match:
CHEMBL3696817

L: Bictegravir
NS3_HCV1B

Docking Scores:
-10.06 -10.79 -7.31
Similarity Score:
35.82%
Best Match:
CHEMBL3954962

L: Darunavir
NS3_HCV1B

Docking Scores:
-8.90 -7.16 -6.11
Similarity Score:
36.30%
Best Match:
CHEMBL1170417

L: Baloxavir marboxil
NS3_HCV1B

Docking Scores:
-6.99 -6.96 -7.00
Similarity Score:
25.95%
Best Match:
CHEMBL1170417

L: Simeprevir
NS3_HCV1B

Docking Scores:
-7.46 -7.85 -7.56
Similarity Score:
53.64%
Best Match:
CHEMBL297884

L: Adefovir dipivoxil
NS3_HCV1B

Docking Scores:
-6.25 -6.86 -5.68
Similarity Score:
17.13%
Best Match:
CHEMBL3125634