RG2_VIRAL_2 #288 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: MOLECULE 127
ACE2_HUMAN

Docking Scores:
-11.28
Similarity Score:
17.97%
Best Match:
CHEMBL257727

L: MOLECULE 25
ACE2_HUMAN

Docking Scores:
-12.87
Similarity Score:
37.07%
Best Match:
CHEMBL1240682

L: MOLECULE 78
ACE2_HUMAN

Docking Scores:
-10.46
Similarity Score:
23.68%
Best Match:
CHEMBL1240682

L: MOLECULE 177
ACE2_HUMAN

Docking Scores:
-13.56
Similarity Score:
22.99%
Best Match:
CHEMBL1240682

L: MOLECULE 20
ACE2_HUMAN

Docking Scores:
-11.39
Similarity Score:
19.87%
Best Match:
CHEMBL401397

L: MOLECULE 127
GP160_HIV1

Docking Scores:
-7.76 -7.79 -6.46
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 25
GP160_HIV1

Docking Scores:
-7.94 -7.93 -7.49
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 78
GP160_HIV1

Docking Scores:
-8.11 -6.86 -7.61
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
GP160_HIV1

Docking Scores:
-8.33 -8.85 -8.68
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
GP160_HIV1

Docking Scores:
-7.87 -7.48 -6.96
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
GP160_HIV2

Docking Scores:
-8.66
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 25
GP160_HIV2

Docking Scores:
-8.84
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 78
GP160_HIV2

Docking Scores:
-7.45
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
GP160_HIV2

Docking Scores:
-8.31
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
GP160_HIV2

Docking Scores:
-7.73
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
GP_EBOV

Docking Scores:
-8.04 ? ?
Similarity Score:
?
Best Match:
?

L: MOLECULE 25
GP_EBOV

Docking Scores:
-9.49 9.45 -4.17
Similarity Score:
34.28%
Best Match:
CHEMBL3125895

L: MOLECULE 78
GP_EBOV

Docking Scores:
-8.89 -8.57 -8.22
Similarity Score:
23.93%
Best Match:
CHEMBL3125898

L: MOLECULE 177
GP_EBOV

Docking Scores:
-8.34 -8.88 -9.52
Similarity Score:
23.79%
Best Match:
CHEMBL3125899

L: MOLECULE 20
GP_EBOV

Docking Scores:
-8.59 26.54 -5.24
Similarity Score:
14.79%
Best Match:
CHEMBL3125899