BDBM50029803 3-{5-[4-(4-Fluoro-benzyloxy)-phenyl]-tetrazol-2-yl}-propionitrile::CHEMBL142909

SMILES: Fc1ccc(COc2ccc(cc2)-c2nnn(CCC#N)n2)cc1

InChI Key: InChIKey=XKPAGPLTNXXBHW-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 = 50029803   

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 (Rattus norvegicus (rat))	BDBM50029803 (3-{5-[4-(4-Fluoro-benzyloxy)-phenyl]-tetrazol-2-yl...) Show SMILES Fc1ccc(COc2ccc(cc2)-c2nnn(CCC#N)n2)cc1 Show InChI InChI=1S/C17H14FN5O/c18-15-6-2-13(3-7-15)12-24-16-8-4-14(5-9-16)17-20-22-23(21-17)11-1-10-19/h2-9H,1,11-12H2	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris 7 Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat brain Monoamine oxidase A				J Med Chem 38: 4786-92 (1996) BindingDB Entry DOI: 10.7270/Q2T72GFV
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50029803 (3-{5-[4-(4-Fluoro-benzyloxy)-phenyl]-tetrazol-2-yl...) Show SMILES Fc1ccc(COc2ccc(cc2)-c2nnn(CCC#N)n2)cc1 Show InChI InChI=1S/C17H14FN5O/c18-15-6-2-13(3-7-15)12-24-16-8-4-14(5-9-16)17-20-22-23(21-17)11-1-10-19/h2-9H,1,11-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris 7 Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat brain Monoamine oxidase B				J Med Chem 38: 4786-92 (1996) BindingDB Entry DOI: 10.7270/Q2T72GFV
					More data for this Ligand-Target Pair