BDBM50287906 4-[4-(3-Chloro-benzyloxy)-2-propionyl-phenoxy]-butyronitrile::CHEMBL19002

SMILES: CCC(=O)c1cc(OCc2cccc(Cl)c2)ccc1OCCCC#N

InChI Key: InChIKey=SUXSVWGNGHSFNP-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 = 50287906   

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))	BDBM50287906 (4-[4-(3-Chloro-benzyloxy)-2-propionyl-phenoxy]-but...) Show SMILES CCC(=O)c1cc(OCc2cccc(Cl)c2)ccc1OCCCC#N Show InChI InChI=1S/C20H20ClNO3/c1-2-19(23)18-13-17(8-9-20(18)24-11-4-3-10-22)25-14-15-6-5-7-16(21)12-15/h5-9,12-13H,2-4,11,14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	400	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