Hydroxychloroquine #112 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Hydroxychloroquine
NS3_HCV1A

Docking Scores:
-5.38 -5.26 -6.55
Similarity Score:
30.19%
Best Match:
CHEMBL4115214

L: Chloroquine
NS3_HCV1A

Docking Scores:
-5.16 -4.69 -5.88
Similarity Score:
29.68%
Best Match:
CHEMBL4115214

L: Hydroxychloroquine
NS3_HCV1B

Docking Scores:
-6.78 -6.73 -4.85
Similarity Score:
20.42%
Best Match:
CHEMBL3954962

L: Chloroquine
NS3_HCV1B

Docking Scores:
-5.49 -5.56 -4.99
Similarity Score:
19.33%
Best Match:
CHEMBL231813

L: Hydroxychloroquine
NS3_HCV3A

Docking Scores:
-5.71 -5.45 -5.36
Similarity Score:
N/A
Best Match:
N/A

L: Chloroquine
NS3_HCV3A

Docking Scores:
-5.88 -5.55 -5.73
Similarity Score:
N/A
Best Match:
N/A

L: Hydroxychloroquine
NS5B_HCV1A

Docking Scores:
-6.85 -6.83 -6.87
Similarity Score:
34.59%
Best Match:
CHEMBL363650

L: Chloroquine
NS5B_HCV1A

Docking Scores:
-6.72 -6.96 -6.85
Similarity Score:
34.11%
Best Match:
CHEMBL363650

L: Hydroxychloroquine
NS5B_HCV1B

Docking Scores:
-6.48 -6.40 -6.39
Similarity Score:
32.00%
Best Match:
CHEMBL99408

L: Chloroquine
NS5B_HCV1B

Docking Scores:
-6.80 -6.48 -6.58
Similarity Score:
34.78%
Best Match:
CHEMBL99408

L: Hydroxychloroquine
NS5B_HCV2A

Docking Scores:
-7.13 -7.37
Similarity Score:
N/A
Best Match:
N/A

L: Chloroquine
NS5B_HCV2A

Docking Scores:
-7.38 -7.77
Similarity Score:
N/A
Best Match:
N/A

L: Hydroxychloroquine
NSP15_SARS

Docking Scores:
-5.76
Similarity Score:
21.57%
Best Match:
CHEMBL2441741

L: Chloroquine
NSP15_SARS

Docking Scores:
-5.37
Similarity Score:
21.43%
Best Match:
CHEMBL3105073

L: Hydroxychloroquine
NSP1_INFB

Docking Scores:
-5.15 -4.88
Similarity Score:
N/A
Best Match:
N/A

L: Chloroquine
NSP1_INFB

Docking Scores:
-5.40 -4.83
Similarity Score:
N/A
Best Match:
N/A

L: Hydroxychloroquine
NSP1_SARS

Docking Scores:
-5.00
Similarity Score:
21.57%
Best Match:
CHEMBL2441741

L: Chloroquine
NSP1_SARS

Docking Scores:
-5.09
Similarity Score:
21.43%
Best Match:
CHEMBL3105073

L: Hydroxychloroquine
NSP3_HCoV-229E

Docking Scores:
-7.68
Similarity Score:
N/A
Best Match:
N/A

L: Chloroquine
NSP3_HCoV-229E

Docking Scores:
-7.74
Similarity Score:
N/A
Best Match:
N/A