New test #188 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Nelfinavir
PA_A-H17N10

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

L: Conivaptan
PA_A-H17N10

Docking Scores:
-9.84
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PA_A-H17N10

Docking Scores:
-8.52
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PA_A-H17N10

Docking Scores:
-10.95
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PA_A-H17N10

Docking Scores:
-8.94
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_A-H1N1

Docking Scores:
-9.75 -7.94 -8.32
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
PA_A-H1N1

Docking Scores:
-10.23 -10.82 -11.09
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PA_A-H1N1

Docking Scores:
-9.08 -8.90 -9.87
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PA_A-H1N1

Docking Scores:
-9.95 -10.16 -11.38
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PA_A-H1N1

Docking Scores:
-10.35 -9.39 -9.87
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_A-H5N1

Docking Scores:
-8.44 -8.67 -8.28
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
PA_A-H5N1

Docking Scores:
-11.53 -10.50 -10.74
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PA_A-H5N1

Docking Scores:
-8.78 -8.15 -8.43
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PA_A-H5N1

Docking Scores:
-11.44 -10.90 -10.78
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PA_A-H5N1

Docking Scores:
-9.82 -9.53 -9.76
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_INFA

Docking Scores:
-9.39 -7.65 -9.44
Similarity Score:
28.57%
Best Match:
CHEMBL278402

L: Conivaptan
PA_INFA

Docking Scores:
-12.60 -9.08 -9.74
Similarity Score:
33.48%
Best Match:
CHEMBL2040578

L: Tipranavir
PA_INFA

Docking Scores:
-9.72 -8.47 -8.54
Similarity Score:
34.05%
Best Match:
CHEMBL2040640

L: Dihydroergotamine
PA_INFA

Docking Scores:
-9.79 -9.98 -9.79
Similarity Score:
28.91%
Best Match:
CHEMBL2040640

L: Eltrombopag
PA_INFA

Docking Scores:
-10.26 -8.84 -9.49
Similarity Score:
27.17%
Best Match:
CHEMBL3600948