BDBM50029821 3-{5-[4-(2-Chloro-benzyloxy)-phenyl]-tetrazol-2-yl}-propionitrile::CHEMBL343248

SMILES: Clc1ccccc1COc1ccc(cc1)-c1nnn(CCC#N)n1

InChI Key: InChIKey=VRWFYOZFVAUHDG-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 = 50029821   

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))	BDBM50029821 (3-{5-[4-(2-Chloro-benzyloxy)-phenyl]-tetrazol-2-yl...) Show SMILES Clc1ccccc1COc1ccc(cc1)-c1nnn(CCC#N)n1 Show InChI InChI=1S/C17H14ClN5O/c18-16-5-2-1-4-14(16)12-24-15-8-6-13(7-9-15)17-20-22-23(21-17)11-3-10-19/h1-2,4-9H,3,11-12H2	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))	BDBM50029821 (3-{5-[4-(2-Chloro-benzyloxy)-phenyl]-tetrazol-2-yl...) Show SMILES Clc1ccccc1COc1ccc(cc1)-c1nnn(CCC#N)n1 Show InChI InChI=1S/C17H14ClN5O/c18-16-5-2-1-4-14(16)12-24-15-8-6-13(7-9-15)17-20-22-23(21-17)11-3-10-19/h1-2,4-9H,3,11-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	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