5 Drug Combinations #119 Output Download CSV

View All
Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Bictegravir
PB4_A-H3N2

Docking Scores:
-9.98
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB4_A-H3N2

Docking Scores:
-9.38
Similarity Score:
N/A
Best Match:
N/A

L: Glimepiride
PB4_A-H3N2

Docking Scores:
-9.12
Similarity Score:
N/A
Best Match:
N/A

L: Fedratinib
PB4_A-H3N2

Docking Scores:
-8.56
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
PB4_A-H3N2

Docking Scores:
-6.11
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PLP_SARS

Docking Scores:
-10.77 -10.34 -10.68
Similarity Score:
29.32%
Best Match:
CHEMBL213054

L: Paritaprevir
PLP_SARS

Docking Scores:
-10.91 -8.75 -8.89
Similarity Score:
31.83%
Best Match:
CHEMBL212080

L: Glimepiride
PLP_SARS

Docking Scores:
-10.56 -11.06 -10.34
Similarity Score:
32.09%
Best Match:
CHEMBL213543

L: Fedratinib
PLP_SARS

Docking Scores:
-10.61 -10.33 -10.06
Similarity Score:
21.55%
Best Match:
CHEMBL212454

L: Oseltamivir
PLP_SARS

Docking Scores:
-6.18 -6.69 -6.44
Similarity Score:
42.31%
Best Match:
CHEMBL212080

L: Bictegravir
PR_FCoV

Docking Scores:
-9.64
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_FCoV

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

L: Glimepiride
PR_FCoV

Docking Scores:
-8.17
Similarity Score:
N/A
Best Match:
N/A

L: Fedratinib
PR_FCoV

Docking Scores:
-7.52
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
PR_FCoV

Docking Scores:
-5.52
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HCoV-229E

Docking Scores:
-9.47 -8.63
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HCoV-229E

Docking Scores:
-8.69 -8.86
Similarity Score:
N/A
Best Match:
N/A

L: Glimepiride
PR_HCoV-229E

Docking Scores:
-8.15 -7.23
Similarity Score:
N/A
Best Match:
N/A

L: Fedratinib
PR_HCoV-229E

Docking Scores:
-7.41 -7.47
Similarity Score:
N/A
Best Match:
N/A

L: Oseltamivir
PR_HCoV-229E

Docking Scores:
-5.54 -5.12
Similarity Score:
N/A
Best Match:
N/A