BDBM50167471 5-(4-Methoxy-phenyl)-11-aza-tricyclo[7.3.1.0*2,7*]trideca-2,4,6-triene::CHEMBL189898

SMILES: COc1ccc(cc1)-c1ccc2C3CNCC(C3)Cc2c1

InChI Key: InChIKey=XDYLQNMRNGKDFX-UHFFFAOYSA-N

Data: 1 KI

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 = 50167471   

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))	BDBM50167471 (5-(4-Methoxy-phenyl)-11-aza-tricyclo[7.3.1.0*2,7*]...) Show SMILES COc1ccc(cc1)-c1ccc2C3CNCC(C3)Cc2c1 Show InChI InChI=1S/C19H21NO/c1-21-18-5-2-14(3-6-18)15-4-7-19-16(10-15)8-13-9-17(19)12-20-11-13/h2-7,10,13,17,20H,8-9,11-12H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Binding affinity against nicotinic acetylcholine receptor alpha4-beta2 in human HEK293 cells using [3H]- nicotine as radioligand				Bioorg Med Chem Lett 15: 2974-9 (2005) Article DOI: 10.1016/j.bmcl.2005.04.036 BindingDB Entry DOI: 10.7270/Q25Q4WWB
					More data for this Ligand-Target Pair