New test #188 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Nelfinavir
PB3_A-H3N2

Docking Scores:
-8.48
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
PB3_A-H3N2

Docking Scores:
-9.33
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PB3_A-H3N2

Docking Scores:
-8.55
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PB3_A-H3N2

Docking Scores:
-10.33
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PB3_A-H3N2

Docking Scores:
-9.60
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PB4_A-H3N2

Docking Scores:
-7.48
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
PB4_A-H3N2

Docking Scores:
-10.08
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PB4_A-H3N2

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PB4_A-H3N2

Docking Scores:
-9.40
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PB4_A-H3N2

Docking Scores:
-10.75
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PLP_SARS

Docking Scores:
-9.05 -9.24 -9.19
Similarity Score:
32.63%
Best Match:
CHEMBL213054

L: Conivaptan
PLP_SARS

Docking Scores:
-11.19 -9.43 -12.36
Similarity Score:
42.33%
Best Match:
CHEMBL358279

L: Tipranavir
PLP_SARS

Docking Scores:
-10.40 -9.98 -10.74
Similarity Score:
25.19%
Best Match:
CHEMBL212080

L: Dihydroergotamine
PLP_SARS

Docking Scores:
-9.59 -9.02 -10.00
Similarity Score:
41.70%
Best Match:
CHEMBL213054

L: Eltrombopag
PLP_SARS

Docking Scores:
-10.78 -11.49 -10.52
Similarity Score:
28.36%
Best Match:
CHEMBL358279

L: Nelfinavir
PLP_SARS2

Docking Scores:
-6.46
Similarity Score:
N/A
Best Match:
N/A

L: Conivaptan
PLP_SARS2

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

L: Tipranavir
PLP_SARS2

Docking Scores:
-6.99
Similarity Score:
N/A
Best Match:
N/A

L: Dihydroergotamine
PLP_SARS2

Docking Scores:
-8.29
Similarity Score:
N/A
Best Match:
N/A

L: Eltrombopag
PLP_SARS2

Docking Scores:
-8.51
Similarity Score:
N/A
Best Match:
N/A