Reaction Details Report a problem with these data
Target
Neuraminidase
Ligand
BDBM50320768
Substrate
n/a
Meas. Tech.
ChEMBL_639158 (CHEMBL1167419)
IC50
33300±n/a nM
Citation
More Info.:
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:
BDBM50320768
Synonyms:
5-Acetamido-2,6-anhydro-4-{N-[3-(morpholinocarbonyl)propyl]guanidino}-3,4,5-trideoxy-D-glycero-D-galactonon-2-enonic acid | CHEMBL1164661
Type:
Small organic molecule
Emp. Form.:
C20H33N5O9
Mol. Mass.:
487.5041
SMILES:
CC(=O)N[C@H]1[C@@H](OC(=C[C@@H]1N(CCCC(=O)N1CCOCC1)C(N)=N)C(O)=O)[C@H](O)[C@H](O)CO |r,c:7|