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SMILES: O=C1N(CCCc2ccccn2)C(=O)c2cccc3cccc1c23

InChI Key: InChIKey=AXNVEQPFTRAYJG-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 68268   
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
Beta-hexosaminidase subunit alpha


(Homo sapiens (Human))		BDBM68268
PNG
(M-31862)
Show SMILES O=C1N(CCCc2ccccn2)C(=O)c2cccc3cccc1c23
Show InChI InChI=1S/C20H16N2O2/c23-19-16-10-3-6-14-7-4-11-17(18(14)16)20(24)22(19)13-5-9-15-8-1-2-12-21-15/h1-4,6-8,10-12H,5,9,13H2
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.08E+5n/an/an/an/an/a25



Research Institute, Hospital for Sick Children



Assay Description
Enzyme assay based on 4-MU substrates with HTS to identify inhibitory compounds for Hex.

Chem Biol 14: 153-64 (2007)


Article DOI: 10.1016/j.chembiol.2006.12.006
BindingDB Entry DOI: 10.7270/Q25B00W8
More data for this
Ligand-Target Pair