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BDBM50341452 5-Acetamido-2,6-anhydro-3,5-dideoxy-4-O-[3-(diisopropylamino)-3-(tosylimino)propoxy]-D-glycero-D-galacto-non-2-enonic acid::CHEMBL1767329

SMILES: CC(C)N(C(C)C)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

InChI Key: InChIKey=WMXGUDSKTQVYCN-ZUEINATDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50341452   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Hemagglutinin-neuraminidase


(Human parainfluenza virus 1)		BDBM50341452
PNG
(5-Acetamido-2,6-anhydro-3,5-dideoxy-4-O-[3-(diisop...)
Show SMILES CC(C)N(C(C)C)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:20.21,c:24|
Show InChI InChI=1S/C27H41N3O10S/c1-15(2)30(16(3)4)23(29-41(37,38)19-9-7-17(5)8-10-19)11-12-39-21-13-22(27(35)36)40-26(24(21)28-18(6)32)25(34)20(33)14-31/h7-13,15-16,20-21,23-26,29,31,33-34H,14H2,1-6H3,(H,28,32)(H,35,36)/t20-,21+,23?,24-,25-,26-/m1/s1
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.80E+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