Reaction Details Report a problem with these data
Target
Neuraminidase
Ligand
BDBM50271264
Substrate
n/a
Meas. Tech.
ChEMBL_1710928 (CHEMBL4120977)
IC50
5010±n/a nM
Citation
 McKimm-Breschkin, JL; Barrett, S; Pilling, PA; Hader, S; Watts, AG; Streltsov, VA Structural and Functional Analysis of Anti-Influenza Activity of 4-, 7-, 8- and 9-Deoxygenated 2,3-Difluoro- N-acetylneuraminic Acid Derivatives. J Med Chem 61:1921-1933 (2018) [PubMed]  Article 
Target
Name:
Neuraminidase
Synonyms:
NA | NRAM_I71A1
Type:
PROTEIN
Mol. Mass.:
52105.18
Organism:
Influenza A virus (strain A/Memphis/1/1971 H3N2)
Description:
ChEMBL_578382
Residue:
469
Sequence:
MNPNQKIITIGSVSLTIATVCFLMQIAILVTTVTLHFKQYECDSPANNQVMPCEPIIIERNITEIVYLTNTTIEKEICPKLVEYRNWSKPQCKITGFAPFSKDNSIRLSAGGDIWVTREPYVSCDPGKCYQFALGQGTTLDNKHSNDTIHDRIPHRTLLMNELGVPFHLGTRQVCIAWSSSSCHDGKAWLHVCVTGDDKNATASFIYDGRLVDSIGSWSQNILRTQESECVCINGTCTVVMTDGSASGRADTRILFIEEGKIVHISPLSGSAQHVEECSCYPRYPGVRCICRDNWKGSNRPVVDINVKDYSIDSRYVCSGLVGDTPRNNDRSSNSNCRNPNNDKGNHGVKGWAFDDGNDVWMGRTISKDSRSGYETFKVIGGWSTPNSKSQINRQVIVDSDNRSGYSGIFSVEGKSCINRCFYVELIRGREQETRVWWTSNSIVVFCGTSGTYGTGSWPDGADINLMPI
  
Inhibitor
Name:
BDBM50271264
Synonyms:
CHEMBL4125754
Type:
Small organic molecule
Emp. Form.:
C11H17F2NO7
Mol. Mass.:
313.252
SMILES:
[H][C@]1(O[C@](F)([C@H](F)[C@H](O)[C@H]1NC(C)=O)C(O)=O)[C@H](O)CCO |r|
Structure:
Search PDB for entries with ligand similarity: