BDBM50264915 5-(5-methyl-1-(piperidin-4-yl)-1H-pyrazol-4-yl)-3-phenylisoxazole::CHEMBL498187

SMILES: Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1

InChI Key: InChIKey=XOFIFFNLXAVCSI-UHFFFAOYSA-N

Data: 1 EC50

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 = 50264915   

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 subunit alpha-4 (Homo sapiens (Human))	BDBM50264915 (5-(5-methyl-1-(piperidin-4-yl)-1H-pyrazol-4-yl)-3-...) Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1 Show InChI InChI=1S/C18H20N4O/c1-13-16(12-20-22(13)15-7-9-19-10-8-15)18-11-17(21-23-18)14-5-3-2-4-6-14/h2-6,11-12,15,19H,7-10H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current				Bioorg Med Chem Lett 18: 5209-12 (2008) Article DOI: 10.1016/j.bmcl.2008.08.080 BindingDB Entry DOI: 10.7270/Q2SX6D26
					More data for this Ligand-Target Pair