BDBM50181853 7-acetonyloxy-3-acetylamino-8-methoxycoumarin::CHEMBL201250::N-(8-methoxy-2-oxo-7-(2-oxopropoxy)-2H-chromen-3-yl)acetamide

SMILES: COc1c(OCC(C)=O)ccc2cc(NC(C)=O)c(=O)oc12

InChI Key: InChIKey=BPSQKFACFYVPBO-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 = 50181853   

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
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50181853 (7-acetonyloxy-3-acetylamino-8-methoxycoumarin | CH...) Show SMILES COc1c(OCC(C)=O)ccc2cc(NC(C)=O)c(=O)oc12 Show InChI InChI=1S/C15H15NO6/c1-8(17)7-21-12-5-4-10-6-11(16-9(2)18)15(19)22-13(10)14(12)20-3/h4-6H,7H2,1-3H3,(H,16,18)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Santiago de Compostela 15782 Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA by fluorimetric method				J Med Chem 51: 6740-51 (2008) Article DOI: 10.1021/jm800656v BindingDB Entry DOI: 10.7270/Q2NV9J3H
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50181853 (7-acetonyloxy-3-acetylamino-8-methoxycoumarin | CH...) Show SMILES COc1c(OCC(C)=O)ccc2cc(NC(C)=O)c(=O)oc12 Show InChI InChI=1S/C15H15NO6/c1-8(17)7-21-12-5-4-10-6-11(16-9(2)18)15(19)22-13(10)14(12)20-3/h4-6H,7H2,1-3H3,(H,16,18)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Santiago de Compostela Curated by ChEMBL					Assay Description Inhibition of MAO-A activity				J Med Chem 49: 1149-56 (2006) Article DOI: 10.1021/jm0509849 BindingDB Entry DOI: 10.7270/Q20864XD
					More data for this Ligand-Target Pair