3 drugs #235 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Tideglusib
PR_HKU4

Docking Scores:
-7.40 -8.14 -8.20
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_IBV

Docking Scores:
-6.26
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_IBV

Docking Scores:
-6.84
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_IBV

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

L: Ebselen
PR_MERs

Docking Scores:
-6.31 -6.44
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_MERs

Docking Scores:
-6.60 -7.25
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_MERs

Docking Scores:
-7.49 -8.38
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_PEDV

Docking Scores:
-6.33
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_PEDV

Docking Scores:
-6.98
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_PEDV

Docking Scores:
-8.11
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_SARS

Docking Scores:
-6.76 -6.91 -6.25
Similarity Score:
22.99%
Best Match:
CHEMBL3105073

L: Shikonin
PR_SARS

Docking Scores:
-6.71 -7.37 -6.89
Similarity Score:
21.90%
Best Match:
CHEMBL1092796

L: Tideglusib
PR_SARS

Docking Scores:
-7.92 -7.28 -7.87
Similarity Score:
20.00%
Best Match:
CHEMBL2441745

L: Ebselen
PR_SARS2

Docking Scores:
-6.55
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_SARS2

Docking Scores:
-6.92
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_SARS2

Docking Scores:
-7.72
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_TGEV

Docking Scores:
-6.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_TGEV

Docking Scores:
-6.66
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_TGEV

Docking Scores:
-7.18
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
RDRP_SARS2

Docking Scores:
-5.74
Similarity Score:
12.82%
Best Match:
CHEMBL4065616