New test #188 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Nelfinavir
NS5B_HCV1A

Docking Scores:
-8.26 -9.76 -9.81
Similarity Score:
38.12%
Best Match:
CHEMBL13256

L: Conivaptan
NS5B_HCV1A

Docking Scores:
-10.39 -11.99 -12.28
Similarity Score:
34.51%
Best Match:
CHEMBL353549

L: Tipranavir
NS5B_HCV1A

Docking Scores:
-8.21 -10.00 -10.92
Similarity Score:
29.67%
Best Match:
CHEMBL3644887

L: Dihydroergotamine
NS5B_HCV1A

Docking Scores:
-10.56 -11.39 -11.70
Similarity Score:
47.53%
Best Match:
CHEMBL68034

L: Eltrombopag
NS5B_HCV1A

Docking Scores:
-10.05 -11.96 -12.37
Similarity Score:
26.29%
Best Match:
CHEMBL3644925

L: Nelfinavir
NS5B_HCV1B

Docking Scores:
-8.52 -8.76 -8.56
Similarity Score:
30.22%
Best Match:
CHEMBL3645202

L: Conivaptan
NS5B_HCV1B

Docking Scores:
-10.40 -11.31 -10.16
Similarity Score:
31.21%
Best Match:
CHEMBL3645193

L: Tipranavir
NS5B_HCV1B

Docking Scores:
-9.52 -9.38 -9.19
Similarity Score:
30.90%
Best Match:
CHEMBL3645202

L: Dihydroergotamine
NS5B_HCV1B

Docking Scores:
-9.24 -9.22 -9.29
Similarity Score:
39.00%
Best Match:
CHEMBL3422106

L: Eltrombopag
NS5B_HCV1B

Docking Scores:
-10.65 -9.69 -9.31
Similarity Score:
27.41%
Best Match:
CHEMBL3645191

L: Nelfinavir
NS5B_HCV2A

Docking Scores:
-8.65 -5.73
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
NS5B_HCV2A

Docking Scores:
-10.38 -7.45
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
NS5B_HCV2A

Docking Scores:
-10.63 -9.16
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
NS5B_HCV2A

Docking Scores:
-10.09 -6.36
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
NS5B_HCV2A

Docking Scores:
-12.16 -11.80
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
NSP15_SARS

Docking Scores:
-6.96
Similarity Score:
33.33%
Best Match:
CHEMBL2441745

L: Conivaptan
NSP15_SARS

Docking Scores:
-7.98
Similarity Score:
19.74%
Best Match:
CHEMBL2441741

L: Tipranavir
NSP15_SARS

Docking Scores:
-7.85
Similarity Score:
22.36%
Best Match:
CHEMBL2441745

L: Dihydroergotamine
NSP15_SARS

Docking Scores:
-8.91
Similarity Score:
47.47%
Best Match:
CHEMBL2441745

L: Eltrombopag
NSP15_SARS

Docking Scores:
-8.45
Similarity Score:
20.18%
Best Match:
CHEMBL2441741