CB2_compounds #193 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: WIN55212-2
ACE2_HUMAN

Docking Scores:
-11.29
Similarity Score:
35.82%
Best Match:
CHEMBL1240682

L: PY1-61
ACE2_HUMAN

Docking Scores:
-9.92
Similarity Score:
36.97%
Best Match:
CHEMBL437595

L: PY2-64
ACE2_HUMAN

Docking Scores:
-9.17
Similarity Score:
23.49%
Best Match:
CHEMBL251804

L: WIN55212-2
GP160_HIV1

Docking Scores:
-6.99 -7.52 -7.01
Similarity Score:
N/A
Best Match:
N/A

L: PY1-61
GP160_HIV1

Docking Scores:
-7.21 -7.11 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: PY2-64
GP160_HIV1

Docking Scores:
-6.64 -7.09 -6.52
Similarity Score:
N/A
Best Match:
N/A

L: WIN55212-2
GP160_HIV2

Docking Scores:
-8.05
Similarity Score:
N/A
Best Match:
N/A

L: PY1-61
GP160_HIV2

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

L: PY2-64
GP160_HIV2

Docking Scores:
-6.00
Similarity Score:
N/A
Best Match:
N/A

L: WIN55212-2
GP_EBOV

Docking Scores:
-8.83 -8.67 -9.02
Similarity Score:
35.07%
Best Match:
CHEMBL3125895

L: PY1-61
GP_EBOV

Docking Scores:
-8.12 -7.79 -8.61
Similarity Score:
21.72%
Best Match:
CHEMBL3125895

L: PY2-64
GP_EBOV

Docking Scores:
-8.54 -7.20 -7.27
Similarity Score:
17.71%
Best Match:
CHEMBL3125895

L: WIN55212-2
HA_A-H10N7

Docking Scores:
-8.37
Similarity Score:
N/A
Best Match:
N/A

L: PY1-61
HA_A-H10N7

Docking Scores:
-6.69
Similarity Score:
N/A
Best Match:
N/A

L: PY2-64
HA_A-H10N7

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

L: WIN55212-2
HA_A-H10N8

Docking Scores:
-7.64
Similarity Score:
N/A
Best Match:
N/A

L: PY1-61
HA_A-H10N8

Docking Scores:
-6.27
Similarity Score:
N/A
Best Match:
N/A

L: PY2-64
HA_A-H10N8

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

L: WIN55212-2
HA_A-H13N6

Docking Scores:
-7.71
Similarity Score:
N/A
Best Match:
N/A

L: PY1-61
HA_A-H13N6

Docking Scores:
-6.61
Similarity Score:
N/A
Best Match:
N/A