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Target
Neuraminidase
Ligand
BDBM4980
Substrate
n/a
Meas. Tech.
ChEMBL_532949 (CHEMBL986926)
IC50
6299411805±n/a nM
Citation
 Lü, WJ; Chen, YL; Ma, WP; Zhang, XY; Luan, F; Liu, MC; Chen, XG; Hu, ZD QSAR study of neuraminidase inhibitors based on heuristic method and radial basis function network. Eur J Med Chem 43:569-76 (2008) [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:
BDBM4980
Synonyms:
(3R,4R,5S)-5-amino-4-acetamido-3-hydroxycyclohex-1-ene-1-carboxylic acid | Carbocyclic Analogue 31
Type:
Small organic molecule
Emp. Form.:
C9H14N2O4
Mol. Mass.:
214.2185
SMILES:
CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1O)C(O)=O |r,c:8|
Structure:
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