3 drugs #235 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Shikonin
RDRP_SARS2

Docking Scores:
-5.88
Similarity Score:
17.04%
Best Match:
CHEMBL4065616

L: Tideglusib
RDRP_SARS2

Docking Scores:
-6.85
Similarity Score:
17.50%
Best Match:
CHEMBL4065616

L: Ebselen
RT_HIV1

Docking Scores:
-8.66 -9.09 -8.80
Similarity Score:
24.60%
Best Match:
CHEMBL4108806

L: Shikonin
RT_HIV1

Docking Scores:
-10.00 -9.87 -9.00
Similarity Score:
40.15%
Best Match:
CHEMBL3775172

L: Tideglusib
RT_HIV1

Docking Scores:
-10.70 -10.00 -10.41
Similarity Score:
23.51%
Best Match:
CHEMBL3928841

L: Ebselen
SPIKE_HCoV-229E

Docking Scores:
-4.87
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HCoV-229E

Docking Scores:
-4.82
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_HCoV-229E

Docking Scores:
-5.86
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HCoV-NL63

Docking Scores:
-5.13
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HCoV-NL63

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

L: Tideglusib
SPIKE_HCoV-NL63

Docking Scores:
-7.34
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HCoV-OC43

Docking Scores:
-5.44
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HCoV-OC43

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

L: Tideglusib
SPIKE_HCoV-OC43

Docking Scores:
-7.04
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HKU4

Docking Scores:
-5.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HKU4

Docking Scores:
-8.28
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_HKU4

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

L: Ebselen
SPIKE_IBV

Docking Scores:
-5.33
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_IBV

Docking Scores:
-5.48
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_IBV

Docking Scores:
-6.49
Similarity Score:
N/A
Best Match:
N/A