BDBM50156417 (R)-1-{4-[5-(4-Methoxy-phenyl)-[1,2,4]oxadiazol-3-ylmethyl]-piperazin-1-yl}-3-(2-methyl-benzothiazol-5-yloxy)-propan-2-ol::CHEMBL186246

SMILES: COc1ccc(cc1)-c1nc(CN2CCN(C[C@@H](O)COc3ccc4sc(C)nc4c3)CC2)no1

InChI Key: InChIKey=KTLZAIRULZYQME-LJQANCHMSA-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 = 50156417   

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
Palmitoyl-CoA oxidase (Rattus norvegicus)	BDBM50156417 ((R)-1-{4-[5-(4-Methoxy-phenyl)-[1,2,4]oxadiazol-3-...) Show SMILES COc1ccc(cc1)-c1nc(CN2CCN(C[C@@H](O)COc3ccc4sc(C)nc4c3)CC2)no1 Show InChI InChI=1S/C25H29N5O4S/c1-17-26-22-13-21(7-8-23(22)35-17)33-16-19(31)14-29-9-11-30(12-10-29)15-24-27-25(34-28-24)18-3-5-20(32-2)6-4-18/h3-8,13,19,31H,9-12,14-16H2,1-2H3/t19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
CV Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibition of palmitoyl-CoA oxidation in rat heart mitochondria				Bioorg Med Chem Lett 14: 6017-21 (2004) Article DOI: 10.1016/j.bmcl.2004.09.077 BindingDB Entry DOI: 10.7270/Q2ZS2W0R
					More data for this Ligand-Target Pair