New test #188 Output Download CSV

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

Docking Scores:
-8.01
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
NP_SARS

Docking Scores:
-8.93
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
NP_SARS

Docking Scores:
-7.55
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
NP_SARS

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

L: Eltrombopag
NP_SARS

Docking Scores:
-9.15
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
NS3_HCV1A

Docking Scores:
-6.08 -6.33 -7.15
Similarity Score:
40.32%
Best Match:
CHEMBL3645661

L: Conivaptan
NS3_HCV1A

Docking Scores:
-8.06 -8.04 -10.28
Similarity Score:
41.95%
Best Match:
CHEMBL3892606

L: Tipranavir
NS3_HCV1A

Docking Scores:
-6.16 -7.01 -9.33
Similarity Score:
28.93%
Best Match:
CHEMBL3891984

L: Dihydroergotamine
NS3_HCV1A

Docking Scores:
-8.89 -8.39 -8.52
Similarity Score:
38.52%
Best Match:
CHEMBL3973032

L: Eltrombopag
NS3_HCV1A

Docking Scores:
-9.45 -8.01 -8.13
Similarity Score:
28.96%
Best Match:
CHEMBL3897232

L: Nelfinavir
NS3_HCV1B

Docking Scores:
-7.49 -6.66 -5.50
Similarity Score:
34.72%
Best Match:
CHEMBL3954962

L: Conivaptan
NS3_HCV1B

Docking Scores:
-11.61 -8.51 -7.69
Similarity Score:
28.03%
Best Match:
CHEMBL1170408

L: Tipranavir
NS3_HCV1B

Docking Scores:
-8.98 -8.86 -6.00
Similarity Score:
32.67%
Best Match:
CHEMBL1170417

L: Dihydroergotamine
NS3_HCV1B

Docking Scores:
-8.58 -8.71 -8.03
Similarity Score:
42.00%
Best Match:
CHEMBL3954962

L: Eltrombopag
NS3_HCV1B

Docking Scores:
-8.73 -10.41 -8.45
Similarity Score:
22.26%
Best Match:
CHEMBL3125634

L: Nelfinavir
NS3_HCV3A

Docking Scores:
-7.38 -6.97 -7.07
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
NS3_HCV3A

Docking Scores:
-8.43 -8.78 -8.93
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
NS3_HCV3A

Docking Scores:
-6.48 -7.86 -6.38
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
NS3_HCV3A

Docking Scores:
-8.83 -9.37 -8.00
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
NS3_HCV3A

Docking Scores:
-8.14 -8.09 -8.39
Similarity Score:
N/A
Best Match:
N/A