trial #445 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: molecule_mod
NS5B_HCV1A

Docking Scores:
-4.44 -5.45 -5.40
Similarity Score:
14.29%
Best Match:
CHEMBL175894

L: molecule
NS5B_HCV1A

Docking Scores:
-4.11 -4.99 -4.84
Similarity Score:
7.14%
Best Match:
CHEMBL175894

L: molecule_mod
NS5B_HCV1B

Docking Scores:
-4.91 -5.38 -5.22
Similarity Score:
18.75%
Best Match:
CHEMBL99408

L: molecule
NS5B_HCV1B

Docking Scores:
-4.55 -4.88 -4.87
Similarity Score:
23.08%
Best Match:
CHEMBL99408

L: molecule_mod
NS5B_HCV2A

Docking Scores:
-5.31 -5.42
Similarity Score:
9.84%
Best Match:
CHEMBL3127326

L: molecule
NS5B_HCV2A

Docking Scores:
-4.69 -4.66
Similarity Score:
4.92%
Best Match:
CHEMBL3127326

L: molecule_mod
NS5_9FLAV

Docking Scores:
-4.50
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NS5_9FLAV

Docking Scores:
-3.98
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
NS5_DEN3S

Docking Scores:
-3.80 -5.09
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NS5_DEN3S

Docking Scores:
-3.46 -4.28
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
NS5_ZIKV

Docking Scores:
-4.55 -3.48
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NS5_ZIKV

Docking Scores:
-4.02 -3.00
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
NS5_ZIKVF

Docking Scores:
-4.46
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NS5_ZIKVF

Docking Scores:
-4.00
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
NS6_9CALI

Docking Scores:
-3.10 -3.66 -3.57
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NS6_9CALI

Docking Scores:
-3.22 -3.27 -3.12
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
NSP15_SARS

Docking Scores:
-3.79
Similarity Score:
14.63%
Best Match:
CHEMBL471187

L: molecule
NSP15_SARS

Docking Scores:
-3.29
Similarity Score:
17.14%
Best Match:
CHEMBL471187

L: molecule_mod
NSP15_SARS2

Docking Scores:
-3.88
Similarity Score:
N/A
Best Match:
N/A

L: molecule
NSP15_SARS2

Docking Scores:
-3.33
Similarity Score:
N/A
Best Match:
N/A