Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hemagglutinin-neuraminidase' and Ligand = 'BDBM50341458'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Hemagglutinin-neuraminidase (Human parainfluenza virus 1)	BDBM50341458 (5-Acetamido-2,6-anhydro-3,5-dideoxy-4-[2-cyclohexe...) Show SMILES CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O)N=C(CC1=CCCCC1)NS(C)(=O)=O |r,w:20.29,c:6,t:23| Show InChI InChI=1S/C20H31N3O9S/c1-11(25)21-17-13(9-15(20(28)29)32-19(17)18(27)14(26)10-24)22-16(23-33(2,30)31)8-12-6-4-3-5-7-12/h6,9,13-14,17-19,24,26-27H,3-5,7-8,10H2,1-2H3,(H,21,25)(H,22,23)(H,28,29)/t13-,14+,17+,18+,19+/m0/s1	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Shizuoka Curated by ChEMBL					Assay Description Inhibition of Human parainfluenza virus 1 sialidase using N-acetyl-alpha-neuramic acid by fluorometric assay				Bioorg Med Chem 19: 2418-27 (2011) Article DOI: 10.1016/j.bmc.2011.02.010 BindingDB Entry DOI: 10.7270/Q2BZ66BM
					More data for this Ligand-Target Pair