BDBM50441364 CHEMBL2435283

SMILES: C1CN2CCC1C(C2)=C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=HDKROIJMOQEIJT-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 = 50441364   

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))	BDBM50441364 (CHEMBL2435283) Show SMILES C1CN2CCC1C(C2)=C(c1ccccc1)c1ccccc1 |(2.78,-7.61,;2.78,-9.15,;4.11,-9.91,;4.5,-8.42,;3.33,-8.16,;4.11,-6.83,;5.44,-7.61,;5.44,-9.15,;6.78,-6.84,;6.78,-5.3,;8.12,-4.54,;8.13,-3,;6.79,-2.23,;5.45,-3,;5.45,-4.54,;8.11,-7.61,;8.1,-9.16,;9.43,-9.93,;10.77,-9.16,;10.77,-7.62,;9.44,-6.85,)| Show InChI InChI=1S/C20H21N/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)19-15-21-13-11-16(19)12-14-21/h1-10,16H,11-15H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc Curated by ChEMBL					Assay Description Displacement of [3H]nicotine from human alpha4beta2 nAChR expressed in human SH-EP1 cell membranes after 2 hrs by liquid scintillation counting analy...				Bioorg Med Chem Lett 23: 4842-7 (2013) Article DOI: 10.1016/j.bmcl.2013.06.094 BindingDB Entry DOI: 10.7270/Q2VT1THP
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