Reaction Details Report a problem with these data
Target
Neuraminidase
Ligand
BDBM50078326
Substrate
n/a
Meas. Tech.
ChEMBL_144720 (CHEMBL750941)
IC50
760000±n/a nM
Citation
Atigadda, VR; Brouillette, WJ; Duarte, F; Ali, SM; Babu, YS; Bantia, S; Chand, P; Chu, N; Montgomery, JA; Walsh, DA; Sudbeck, EA; Finley, J; Luo, M; Air, GM; Laver, GW Potent inhibition of influenza sialidase by a benzoic acid containing a 2-pyrrolidinone substituent. J Med Chem 42:2332-43 (1999) [PubMed] Article
More Info.:
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:
BDBM50078326
Synonyms:
4-(2,2-Bis-hydroxymethyl-5-oxo-pyrrolidin-1-yl)-benzoic acid | 4-(2,2-Bis-hydroxymethyl-5-oxo-pyrrolidin-1-yl)-benzoic acid anion | CHEMBL74433
Type:
Small organic molecule
Emp. Form.:
C13H15NO5
Mol. Mass.:
265.2619
SMILES:
OCC1(CO)CCC(=O)N1c1ccc(cc1)C(O)=O