Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Amine oxidase [flavin-containing] B' and Ligand = 'BDBM50327216'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50327216 (3-Benzyl-2-(2-(2-chlorobenzylidene)hydrazinyl)quin...) Show SMILES Clc1ccccc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:9.10| Show InChI InChI=1S/C22H17ClN4/c23-18-11-5-4-10-17(18)15-24-27-22-21(14-16-8-2-1-3-9-16)25-19-12-6-7-13-20(19)26-22/h1-13H,14-15H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Alexandria University Curated by ChEMBL					Assay Description Inhibition of MAOB by spectrophotometry				Eur J Med Chem 45: 4479-89 (2010) Article DOI: 10.1016/j.ejmech.2010.07.008 BindingDB Entry DOI: 10.7270/Q21G0N86
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