p62_compounds #191 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: XRK3F2
ACE2_HUMAN

Docking Scores:
-8.85
Similarity Score:
41.22%
Best Match:
CHEMBL254911

L: XIE5-1-23
ACE2_HUMAN

Docking Scores:
-10.18
Similarity Score:
30.00%
Best Match:
CHEMBL251809

L: XIE5-2-25
ACE2_HUMAN

Docking Scores:
-9.57
Similarity Score:
29.05%
Best Match:
CHEMBL251809

L: XRK3
ACE2_HUMAN

Docking Scores:
-8.41
Similarity Score:
37.10%
Best Match:
CHEMBL254703

L: XIE106
ACE2_HUMAN

Docking Scores:
-10.12
Similarity Score:
45.52%
Best Match:
CHEMBL254911

L: XRK3F2
GP160_HIV1

Docking Scores:
-7.54 -7.79 -7.57
Similarity Score:
N/A
Best Match:
N/A

L: XIE5-1-23
GP160_HIV1

Docking Scores:
-6.30 -6.99 -6.54
Similarity Score:
N/A
Best Match:
N/A

L: XIE5-2-25
GP160_HIV1

Docking Scores:
-8.19 -8.27 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: XRK3
GP160_HIV1

Docking Scores:
-7.28 -7.33 -5.73
Similarity Score:
N/A
Best Match:
N/A

L: XIE106
GP160_HIV1

Docking Scores:
-8.09 -7.89 -8.98
Similarity Score:
N/A
Best Match:
N/A

L: XRK3F2
GP160_HIV2

Docking Scores:
-6.89
Similarity Score:
N/A
Best Match:
N/A

L: XIE5-1-23
GP160_HIV2

Docking Scores:
-6.65
Similarity Score:
N/A
Best Match:
N/A

L: XIE5-2-25
GP160_HIV2

Docking Scores:
-8.41
Similarity Score:
N/A
Best Match:
N/A

L: XRK3
GP160_HIV2

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

L: XIE106
GP160_HIV2

Docking Scores:
-8.00
Similarity Score:
N/A
Best Match:
N/A

L: XRK3F2
GP_EBOV

Docking Scores:
-7.02 -8.42 -7.82
Similarity Score:
17.06%
Best Match:
CHEMBL3125895

L: XIE5-1-23
GP_EBOV

Docking Scores:
-7.59 -8.87 -8.99
Similarity Score:
14.06%
Best Match:
CHEMBL3125895

L: XIE5-2-25
GP_EBOV

Docking Scores:
-8.04 -8.47 -8.88
Similarity Score:
15.33%
Best Match:
CHEMBL3125895

L: XRK3
GP_EBOV

Docking Scores:
-6.73 -8.08 -7.70
Similarity Score:
16.67%
Best Match:
CHEMBL3125895

L: XIE106
GP_EBOV

Docking Scores:
-7.61 -9.19 -8.68
Similarity Score:
20.55%
Best Match:
CHEMBL3125895