BDBM50223063 2,4-dimethyl-9-phenethyl-3-oxa-9-aza-6-azonia-spiro[5.5]undecane chloride::CHEMBL250599

SMILES: CC1C[N+]2(CCN(CCc3ccccc3)CC2)CC(C)O1

InChI Key: InChIKey=MIUCUOYKIMCQKO-UHFFFAOYSA-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 = 50223063   

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
Neuronal acetylcholine receptor Alpha-4/Beta-2 (Homo sapiens (Human))	BDBM50223063 (2,4-dimethyl-9-phenethyl-3-oxa-9-aza-6-azonia-spir...) Show SMILES CC1C[N+]2(CCN(CCc3ccccc3)CC2)CC(C)O1 |w:1.0,18.20| Show InChI InChI=1S/C18H29N2O/c1-16-14-20(15-17(2)21-16)12-10-19(11-13-20)9-8-18-6-4-3-5-7-18/h3-7,16-17H,8-15H2,1-2H3/q+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of alpha-4-beta-2 nAChR				Bioorg Med Chem Lett 17: 6245-9 (2007) Article DOI: 10.1016/j.bmcl.2007.09.026 BindingDB Entry DOI: 10.7270/Q24J0GBN
					More data for this Ligand-Target Pair