BDBM50047033 3-{5-[4-(4-Methyl-benzyloxy)-phenyl]-2-thioxo-[1,3,4]oxadiazol-3-yl}-propionitrile::CHEMBL17081

SMILES: Cc1ccc(COc2ccc(cc2)-c2nn(CCC#N)c(=S)o2)cc1

InChI Key: InChIKey=BMFGLWLVJFBXKE-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50047033   

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))	BDBM50047033 (3-{5-[4-(4-Methyl-benzyloxy)-phenyl]-2-thioxo-[1,3...) Show SMILES Cc1ccc(COc2ccc(cc2)-c2nn(CCC#N)c(=S)o2)cc1 Show InChI InChI=1S/C19H17N3O2S/c1-14-3-5-15(6-4-14)13-23-17-9-7-16(8-10-17)18-21-22(12-2-11-20)19(25)24-18/h3-10H,2,12-13H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris 7 Curated by ChEMBL					Assay Description In vitro inhibitory activity on rat brain MAO-B.				J Med Chem 36: 1157-67 (1993) BindingDB Entry DOI: 10.7270/Q2765FZP
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50047033 (3-{5-[4-(4-Methyl-benzyloxy)-phenyl]-2-thioxo-[1,3...) Show SMILES Cc1ccc(COc2ccc(cc2)-c2nn(CCC#N)c(=S)o2)cc1 Show InChI InChI=1S/C19H17N3O2S/c1-14-3-5-15(6-4-14)13-23-17-9-7-16(8-10-17)18-21-22(12-2-11-20)19(25)24-18/h3-10H,2,12-13H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris 7 Curated by ChEMBL					Assay Description In vitro inhibitory activity on rat brain by monoamine oxidase A (MAO-A)				J Med Chem 36: 1157-67 (1993) BindingDB Entry DOI: 10.7270/Q2765FZP
					More data for this Ligand-Target Pair