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Target
Neuraminidase
Ligand
BDBM50469488
Substrate
n/a
Meas. Tech.
ChEMBL_2238272 (CHEMBL5152168)
IC50
1.9±n/a nM
Citation
 Ju, H; Murugan, NA; Hou, L; Li, P; Guizzo, L; Zhang, Y; Bertagnin, C; Kong, X; Kang, D; Jia, R; Ma, X; Du, R; Poongavanam, V; Loregian, A; Huang, B; Liu, X; Zhan, P Identification of C5-NH J Med Chem 64:17992-18009 (2021) [PubMed] 
Target
Name:
Neuraminidase
Synonyms:
Influenza A Virus Neuraminidase | NA | NRAM_I34A1 | Neuraminidase | Neuraminidase A
Type:
Enzyme
Mol. Mass.:
50124.14
Organism:
Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(H1N1))
Description:
P03468
Residue:
454
Sequence:
MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK
  
Inhibitor
Name:
BDBM50469488
Synonyms:
CHEMBL4287425
Type:
Small organic molecule
Emp. Form.:
C27H34N2O4S
Mol. Mass.:
482.635
SMILES:
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(Sc3ccccc3)cc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
Structure:
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