Nirmatrelvir modification 02 #419 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Nirmatrelvir
ACE2_HUMAN

Docking Scores:
-9.56
Similarity Score:
38.64%
Best Match:
CHEMBL254900

L: Nirmatrelvir Modify 02
ACE2_HUMAN

Docking Scores:
-11.11
Similarity Score:
52.10%
Best Match:
CHEMBL400526

L: Nirmatrelvir
CAPSD_9CALI

Docking Scores:
-7.98 -6.68 -7.93
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
CAPSD_9CALI

Docking Scores:
-8.61 -7.71 -8.66
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
CAPSD_9ENTO

Docking Scores:
-6.30
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
CAPSD_9ENTO

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

L: Nirmatrelvir
CAPSD_DEN2P

Docking Scores:
-5.95
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
CAPSD_DEN2P

Docking Scores:
-7.17
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
CAPSD_HCV77

Docking Scores:
-4.38
Similarity Score:
60.67%
Best Match:
CHEMBL296588

L: Nirmatrelvir Modify 02
CAPSD_HCV77

Docking Scores:
-5.21
Similarity Score:
45.76%
Best Match:
CHEMBL296588

L: Nirmatrelvir
CAPSD_HED68

Docking Scores:
-8.13 -9.58
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
CAPSD_HED68

Docking Scores:
-8.88 -9.93
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
CAPSD_ZIKV

Docking Scores:
-6.13 -5.91
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
CAPSD_ZIKV

Docking Scores:
-6.77 -6.62
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
DPM_HHV1K

Docking Scores:
-7.76
Similarity Score:
16.31%
Best Match:
CHEMBL479371

L: Nirmatrelvir Modify 02
DPM_HHV1K

Docking Scores:
-8.95
Similarity Score:
24.48%
Best Match:
CHEMBL479371

L: Nirmatrelvir
E1_9HEPC

Docking Scores:
-5.33
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
E1_9HEPC

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

L: Nirmatrelvir
E1_HCV77

Docking Scores:
-4.66
Similarity Score:
60.67%
Best Match:
CHEMBL296588

L: Nirmatrelvir Modify 02
E1_HCV77

Docking Scores:
-4.60
Similarity Score:
45.76%
Best Match:
CHEMBL296588