Reaction Details  Report a problem with these data
Target
Neuraminidase
Ligand
BDBM50512407
Substrate
n/a
Meas. Tech.
ChEMBL_1848854 (CHEMBL4349395)
IC50
7100±n/a nM
Citation
 Zhao, ZX; Cheng, LP; Li, M; Pang, W; Wu, FH Discovery of novel acylhydrazone neuraminidase inhibitors. Eur J Med Chem 173:305-313 (2019) [PubMed]  Article
Target
Name:
Neuraminidase
Synonyms:
NA | NRAM_I33A0
Type:
PROTEIN
Mol. Mass.:
49687.56
Organism:
Influenza A virus
Description:
ChEMBL_1347422
Residue:
453
Sequence:
MNPNQKIITIGSICMVVGIISLILQIGNIISIWISHSIQTGNQNHTGICNQGIITYNVVAGQDSTSVILTGNSSLCPIRGWAIHSKDNGIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECTCVNGSCFTIMTDGPSNGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPKDGPGSCGPVSADGANGVKGFSYRYGNGVWIGRTKSDSSRHGFEMIWDPNGWTETDSRFSVRQDVVAMTDRSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPEEETIWTSGSIISFCGVNSDTVDWSWPDGAELPFTIDK
  
Inhibitor
Name:
BDBM50512407
Synonyms:
CHEMBL4470134
Type:
Small organic molecule
Emp. Form.:
C17H24N4O4
Mol. Mass.:
348.3969
SMILES:
COc1ccccc1\C=N\NC(=O)C(=O)NCCCN1CCOCC1
Structure:
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