Nirmatrelvir modification #418 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Nirmatrelvir Modify
PR_FCoV

Docking Scores:
-8.66
Similarity Score:
48.08%
Best Match:
CHEMBL4214471

L: Nirmatrelvir
PR_FCoV

Docking Scores:
-7.04
Similarity Score:
52.83%
Best Match:
CHEMBL4214066

L: Nirmatrelvir Modify
PR_HCoV-229E

Docking Scores:
-7.85 -7.80
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_HCoV-229E

Docking Scores:
-7.67 -7.48
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_HCoV-NL63

Docking Scores:
-4.18 -8.04
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_HCoV-NL63

Docking Scores:
-4.55 -7.50
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_HIV1

Docking Scores:
-7.43 -8.09 -7.52
Similarity Score:
28.72%
Best Match:
CHEMBL492666

L: Nirmatrelvir
PR_HIV1

Docking Scores:
-6.46 -6.72 -7.03
Similarity Score:
17.03%
Best Match:
CHEMBL492666

L: Nirmatrelvir Modify
PR_HIV2

Docking Scores:
-7.50 -7.64
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_HIV2

Docking Scores:
-7.47 -6.82
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_HKU1

Docking Scores:
-6.49
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_HKU1

Docking Scores:
-6.35
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_HKU4

Docking Scores:
-7.96 -7.43 -7.37
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_HKU4

Docking Scores:
-6.75 -7.19 -7.32
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_IBV

Docking Scores:
-6.95
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_IBV

Docking Scores:
-6.96
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_MERs

Docking Scores:
-7.20 -8.51
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_MERs

Docking Scores:
-7.55 -8.02
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
PR_PEDV

Docking Scores:
-8.07
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
PR_PEDV

Docking Scores:
-7.85
Similarity Score:
N/A
Best Match:
N/A