Nirmatrelvir modification #418 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Nirmatrelvir Modify
NSP1_INFB

Docking Scores:
-6.90 -6.72
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
NSP1_INFB

Docking Scores:
-6.71 -6.37
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
NSP1_SARS

Docking Scores:
-6.40
Similarity Score:
63.36%
Best Match:
CHEMBL2441741

L: Nirmatrelvir
NSP1_SARS

Docking Scores:
-6.15
Similarity Score:
42.31%
Best Match:
CHEMBL2441741

L: Nirmatrelvir Modify
NSP3_HCoV-229E

Docking Scores:
-9.27
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
NSP3_HCoV-229E

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

L: Nirmatrelvir Modify
NSP3_IBV

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

L: Nirmatrelvir
NSP3_IBV

Docking Scores:
-7.06
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
NSP3_MHV

Docking Scores:
-6.04
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
NSP3_MHV

Docking Scores:
-6.14
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
NSP3_SARS2

Docking Scores:
-8.23
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
NSP3_SARS2

Docking Scores:
-7.45
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
NSP9_HCoV-229E

Docking Scores:
-7.50 -6.88
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
NSP9_HCoV-229E

Docking Scores:
-6.39 -6.81
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PA_A-H17N10

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

L: Nirmatrelvir
PA_A-H17N10

Docking Scores:
-7.62
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PA_A-H1N1

Docking Scores:
-9.64 -8.43 -8.20
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PA_A-H1N1

Docking Scores:
-7.61 -7.57 -7.81
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PA_A-H5N1

Docking Scores:
-9.26 -8.65 -8.79
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PA_A-H5N1

Docking Scores:
-7.81 -7.48 -7.56
Similarity Score:
N/A
Best Match:
N/A