SARS2v4 #174 Output Download CSV

View All
Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Tetrandrine
PR_SARS

Docking Scores:
-7.57 -7.43 -8.07
Similarity Score:
27.35%
Best Match:
CHEMBL471187

L: Berbamine
PR_SARS

Docking Scores:
-7.49 -7.67 -7.28
Similarity Score:
27.35%
Best Match:
CHEMBL471187

L: Anidulafungin
PR_SARS

Docking Scores:
-7.69 -7.38 -8.09
Similarity Score:
44.32%
Best Match:
CHEMBL2441741

L: Gilteritinib
PR_SARS

Docking Scores:
-8.42 -8.05 -8.12
Similarity Score:
21.88%
Best Match:
CHEMBL2441745

L: Abemaciclib
PR_SARS

Docking Scores:
-8.37 -8.60 -8.81
Similarity Score:
21.52%
Best Match:
CHEMBL3105073

L: Tetrandrine
PR_SARS2

Docking Scores:
-7.12
Similarity Score:
N/A
Best Match:
N/A

L: Berbamine
PR_SARS2

Docking Scores:
-8.19
Similarity Score:
N/A
Best Match:
N/A

L: Anidulafungin
PR_SARS2

Docking Scores:
-8.68
Similarity Score:
N/A
Best Match:
N/A

L: Gilteritinib
PR_SARS2

Docking Scores:
-8.38
Similarity Score:
N/A
Best Match:
N/A

L: Abemaciclib
PR_SARS2

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

L: Tetrandrine
PR_TGEV

Docking Scores:
-7.14
Similarity Score:
N/A
Best Match:
N/A

L: Berbamine
PR_TGEV

Docking Scores:
-7.32
Similarity Score:
N/A
Best Match:
N/A

L: Anidulafungin
PR_TGEV

Docking Scores:
-7.88
Similarity Score:
N/A
Best Match:
N/A

L: Gilteritinib
PR_TGEV

Docking Scores:
-7.98
Similarity Score:
N/A
Best Match:
N/A

L: Abemaciclib
PR_TGEV

Docking Scores:
-8.61
Similarity Score:
N/A
Best Match:
N/A

L: Tetrandrine
RT_HIV1

Docking Scores:
-7.12 -5.66 -5.82
Similarity Score:
30.34%
Best Match:
CHEMBL4227326

L: Berbamine
RT_HIV1

Docking Scores:
-7.04 -5.29 -5.85
Similarity Score:
30.34%
Best Match:
CHEMBL4227326

L: Anidulafungin
RT_HIV1

Docking Scores:
40.17 ? ?
Similarity Score:
?
Best Match:
?

L: Gilteritinib
RT_HIV1

Docking Scores:
-9.52 -9.14 -9.34
Similarity Score:
25.96%
Best Match:
CHEMBL3683705

L: Abemaciclib
RT_HIV1

Docking Scores:
-9.25 -9.75 -9.42
Similarity Score:
31.67%
Best Match:
CHEMBL4288759