New v2 #183 Output Download CSV

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

Docking Scores:
-7.07
Similarity Score:
29.07%
Best Match:
CHEMBL401086

L: Amodiaquine
ACE2_HUMAN

Docking Scores:
-8.44
Similarity Score:
48.51%
Best Match:
CHEMBL76

L: Amodiaquine hydrochloride
ACE2_HUMAN

Docking Scores:
-8.71
Similarity Score:
48.51%
Best Match:
CHEMBL76

L: Mefloquine
ACE2_HUMAN

Docking Scores:
-9.24
Similarity Score:
39.11%
Best Match:
CHEMBL1240682

L: Imatinib
ACE2_HUMAN

Docking Scores:
-12.07
Similarity Score:
24.72%
Best Match:
CHEMBL1240682

L: Chlorpromazine
GP160_HIV1

Docking Scores:
-5.14 -5.24 -5.39
Similarity Score:
N/A
Best Match:
N/A

L: Amodiaquine
GP160_HIV1

Docking Scores:
-5.91 -5.79 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Amodiaquine hydrochloride
GP160_HIV1

Docking Scores:
-6.15 -5.75 -6.10
Similarity Score:
N/A
Best Match:
N/A

L: Mefloquine
GP160_HIV1

Docking Scores:
-6.53 -6.59 -6.83
Similarity Score:
N/A
Best Match:
N/A

L: Imatinib
GP160_HIV1

Docking Scores:
-7.90 -8.75 -7.44
Similarity Score:
N/A
Best Match:
N/A

L: Chlorpromazine
GP160_HIV2

Docking Scores:
-5.53
Similarity Score:
N/A
Best Match:
N/A

L: Amodiaquine
GP160_HIV2

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

L: Amodiaquine hydrochloride
GP160_HIV2

Docking Scores:
-6.05
Similarity Score:
N/A
Best Match:
N/A

L: Mefloquine
GP160_HIV2

Docking Scores:
-7.18
Similarity Score:
N/A
Best Match:
N/A

L: Imatinib
GP160_HIV2

Docking Scores:
-8.15
Similarity Score:
N/A
Best Match:
N/A

L: Chlorpromazine
GP_EBOV

Docking Scores:
-5.93 -6.46 -5.95
Similarity Score:
23.31%
Best Match:
CHEMBL3125897

L: Amodiaquine
GP_EBOV

Docking Scores:
-7.07 -7.05 -7.28
Similarity Score:
18.82%
Best Match:
CHEMBL3125895

L: Amodiaquine hydrochloride
GP_EBOV

Docking Scores:
-6.64 -6.21 -6.39
Similarity Score:
18.82%
Best Match:
CHEMBL3125895

L: Mefloquine
GP_EBOV

Docking Scores:
-7.04 -7.66 -7.52
Similarity Score:
35.74%
Best Match:
CHEMBL3125895

L: Imatinib
GP_EBOV

Docking Scores:
-9.32 -8.91 -8.55
Similarity Score:
23.10%
Best Match:
CHEMBL3125899