Nirmatrelvir modification #418 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Nirmatrelvir Modify
G1_ADNV

Docking Scores:
-3.73 -7.10 -7.23
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
G1_ADNV

Docking Scores:
-3.58 -6.01 -6.16
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
G2_ADNV

Docking Scores:
-8.89 -8.28 -7.55
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
G2_ADNV

Docking Scores:
-7.01 -7.23 -6.41
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GB_HHV11

Docking Scores:
-8.09
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GB_HHV11

Docking Scores:
-6.84
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GB_HHV1K

Docking Scores:
-8.21 -8.26
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GB_HHV1K

Docking Scores:
-6.99 -7.22
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GD_9ALPH

Docking Scores:
-7.50 -6.06
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GD_9ALPH

Docking Scores:
-6.93 -6.40
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GD_HHV1

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

L: Nirmatrelvir
GD_HHV1

Docking Scores:
-6.11
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GP160_HIV1

Docking Scores:
-6.79 -6.95 -7.29
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GP160_HIV1

Docking Scores:
-6.83 -7.22 -7.33
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GP160_HIV2

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

L: Nirmatrelvir
GP160_HIV2

Docking Scores:
-6.61
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify
GP_EBOV

Docking Scores:
-7.48 -7.36 -7.63
Similarity Score:
38.36%
Best Match:
CHEMBL3125895

L: Nirmatrelvir
GP_EBOV

Docking Scores:
-7.04 -7.03 -6.62
Similarity Score:
33.54%
Best Match:
CHEMBL3125897

L: Nirmatrelvir Modify
GP_LASSJ

Docking Scores:
-7.28 -6.39
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GP_LASSJ

Docking Scores:
-6.19 -5.96
Similarity Score:
N/A
Best Match:
N/A