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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hemagglutinin-neuraminidase' and Ligand = 'BDBM50341453'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Hemagglutinin-neuraminidase


(Human parainfluenza virus 1)		BDBM50341453
PNG
(5-Acetamido-2,6-anhydro-3,5-dideoxy-4-O-[3-(diethy...)
Show SMILES CCN(CC)C(NS(=O)(=O)c1ccc(C)cc1)C=CO[C@H]1C=C(O[C@@H]([C@H](O)[C@H](O)CO)[C@@H]1NC(C)=O)C(O)=O |r,w:18.19,c:22|
Show InChI InChI=1S/C25H37N3O10S/c1-5-28(6-2)21(27-39(35,36)17-9-7-15(3)8-10-17)11-12-37-19-13-20(25(33)34)38-24(22(19)26-16(4)30)23(32)18(31)14-29/h7-13,18-19,21-24,27,29,31-32H,5-6,14H2,1-4H3,(H,26,30)(H,33,34)/t18-,19+,21?,22-,23-,24-/m1/s1
UniProtKB/TrEMBL

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 9.10E+6n/an/an/an/an/an/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