BDBM50264765 3-methyl-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)isoxazole::CHEMBL509878

SMILES: Cc1cc(on1)-c1cnn(c1)C1CCNCC1

InChI Key: InChIKey=PITRDXBGXXUQET-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 = 50264765   

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))	BDBM50264765 (3-methyl-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)iso...) Show SMILES Cc1cc(on1)-c1cnn(c1)C1CCNCC1 Show InChI InChI=1S/C12H16N4O/c1-9-6-12(17-15-9)10-7-14-16(8-10)11-2-4-13-5-3-11/h6-8,11,13H,2-5H2,1H3	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	1.30E+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