3 drugs #235 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Ebselen
PR_FCoV

Docking Scores:
-6.56
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_FCoV

Docking Scores:
-6.74
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_FCoV

Docking Scores:
-7.59
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HCoV-229E

Docking Scores:
-6.43 -6.36
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HCoV-229E

Docking Scores:
-6.58 -6.42
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HCoV-229E

Docking Scores:
-7.99 -7.29
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HCoV-NL63

Docking Scores:
-4.68 -6.86
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HCoV-NL63

Docking Scores:
-5.43 -7.05
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HCoV-NL63

Docking Scores:
-5.53 -8.21
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HIV1

Docking Scores:
-6.55 -6.34 -6.18
Similarity Score:
17.31%
Best Match:
CHEMBL494500

L: Shikonin
PR_HIV1

Docking Scores:
-6.73 -6.71 -6.65
Similarity Score:
21.08%
Best Match:
CHEMBL492666

L: Tideglusib
PR_HIV1

Docking Scores:
-7.34 -6.96 -7.40
Similarity Score:
18.26%
Best Match:
CHEMBL492666

L: Ebselen
PR_HIV2

Docking Scores:
-6.92 -5.45
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HIV2

Docking Scores:
-7.11 -5.94
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HIV2

Docking Scores:
-7.96 -6.96
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HKU1

Docking Scores:
-6.57
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HKU1

Docking Scores:
-6.07
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HKU1

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

L: Ebselen
PR_HKU4

Docking Scores:
-6.21 -6.59 -6.58
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HKU4

Docking Scores:
-6.81 -6.88 -7.09
Similarity Score:
N/A
Best Match:
N/A