Reaction Details Report a problem with these data
Target
Neuraminidase
Ligand
BDBM50483712
Substrate
n/a
Meas. Tech.
ChEMBL_741751 (CHEMBL1769850)
IC50
8640±n/a nM
Citation
 Liu, Y; Jing, F; Xu, Y; Xie, Y; Shi, F; Fang, H; Li, M; Xu, W Design, synthesis and biological activity of thiazolidine-4-carboxylic acid derivatives as novel influenza neuraminidase inhibitors. Bioorg Med Chem 19:2342-8 (2011) [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:
BDBM50483712
Synonyms:
CHEMBL1767346
Type:
Small organic molecule
Emp. Form.:
C13H11ClN2O3S
Mol. Mass.:
310.756
SMILES:
OC(=O)[C@@H]1CSC(N1C(=O)CCl)c1ccc(cc1)C#N |r|
Structure:
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