BDBM50287908 1-[2-(2-Hydroxy-3-methoxy-propoxy)-5-(3-trifluoromethyl-benzyloxy)-phenyl]-ethanone::CHEMBL278669

SMILES: COCC(O)COc1ccc(OCc2cccc(c2)C(F)(F)F)cc1C(C)=O

InChI Key: InChIKey=XEMABSKOHROFJL-UHFFFAOYSA-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 = 50287908   

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
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50287908 (1-[2-(2-Hydroxy-3-methoxy-propoxy)-5-(3-trifluorom...) Show SMILES COCC(O)COc1ccc(OCc2cccc(c2)C(F)(F)F)cc1C(C)=O Show InChI InChI=1S/C20H21F3O5/c1-13(24)18-9-17(6-7-19(18)28-12-16(25)11-26-2)27-10-14-4-3-5-15(8-14)20(21,22)23/h3-9,16,25H,10-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against monoamine oxidase B (MAO-B).				Bioorg Med Chem Lett 6: 115-120 (1996) Article DOI: 10.1016/0960-894X(95)00561-7 BindingDB Entry DOI: 10.7270/Q2WS8TQ0
					More data for this Ligand-Target Pair