BDBM50320766 5-Acetamido-2,6-anhydro-4-(3-aminopropyl)amino-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid::CHEMBL1164064

SMILES: CC(=O)N[C@@H]1[C@@H](NCCCN)C=C(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O

InChI Key: InChIKey=QGCOTIJSSPCRFA-IINAIABHSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50320766   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuraminidase (Influenza A virus)	BDBM50320766 (5-Acetamido-2,6-anhydro-4-(3-aminopropyl)amino-3,4...) Show SMILES CC(=O)N[C@@H]1[C@@H](NCCCN)C=C(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O |r,c:11| Show InChI InChI=1S/C14H25N3O7/c1-7(19)17-11-8(16-4-2-3-15)5-10(14(22)23)24-13(11)12(21)9(20)6-18/h5,8-9,11-13,16,18,20-21H,2-4,6,15H2,1H3,(H,17,19)(H,22,23)/t8-,9+,11+,12+,13+/m0/s1	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus A/WSN/1933(H1N1) neuraminidase				Bioorg Med Chem 18: 4074-84 (2010) Article DOI: 10.1016/j.bmc.2010.04.010 BindingDB Entry DOI: 10.7270/Q2WD41KC
					More data for this Ligand-Target Pair