RG2_VIRAL_2 #288 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: MOLECULE 127
NS5B_HCV1A

Docking Scores:
-9.55 -7.76 -8.32
Similarity Score:
17.94%
Best Match:
CHEMBL176058

L: MOLECULE 25
NS5B_HCV1A

Docking Scores:
-8.78 -8.82 -8.61
Similarity Score:
41.26%
Best Match:
CHEMBL68034

L: MOLECULE 78
NS5B_HCV1A

Docking Scores:
-9.50 -10.84 -10.71
Similarity Score:
33.75%
Best Match:
CHEMBL353549

L: MOLECULE 177
NS5B_HCV1A

Docking Scores:
-12.41 -9.97 -11.56
Similarity Score:
25.58%
Best Match:
CHEMBL353549

L: MOLECULE 20
NS5B_HCV1A

Docking Scores:
-11.25 -8.12 -9.29
Similarity Score:
22.45%
Best Match:
CHEMBL354813

L: MOLECULE 127
NS5B_HCV1B

Docking Scores:
-11.93 -9.94 -8.74
Similarity Score:
17.39%
Best Match:
CHEMBL3645203

L: MOLECULE 25
NS5B_HCV1B

Docking Scores:
-10.58 -9.94 -8.93
Similarity Score:
32.41%
Best Match:
CHEMBL3645183

L: MOLECULE 78
NS5B_HCV1B

Docking Scores:
-7.85 -9.71 -8.93
Similarity Score:
31.14%
Best Match:
CHEMBL3645204

L: MOLECULE 177
NS5B_HCV1B

Docking Scores:
-8.70 -9.21 -9.00
Similarity Score:
26.98%
Best Match:
CHEMBL3645193

L: MOLECULE 20
NS5B_HCV1B

Docking Scores:
-9.35 -8.58 -8.53
Similarity Score:
17.49%
Best Match:
CHEMBL3645203

L: MOLECULE 127
NS5B_HCV2A

Docking Scores:
-9.07 26.91
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 25
NS5B_HCV2A

Docking Scores:
-8.42 27.18
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 78
NS5B_HCV2A

Docking Scores:
-9.01 -3.34
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
NS5B_HCV2A

Docking Scores:
-8.46 ?
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
NS5B_HCV2A

Docking Scores:
-8.71 16.35
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
NSP15_SARS

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

L: MOLECULE 25
NSP15_SARS

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

L: MOLECULE 78
NSP15_SARS

Docking Scores:
-6.93
Similarity Score:
19.29%
Best Match:
CHEMBL2441745

L: MOLECULE 177
NSP15_SARS

Docking Scores:
6.46
Similarity Score:
17.03%
Best Match:
CHEMBL2441745

L: MOLECULE 20
NSP15_SARS

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