BDBM50307363 (+/-)-2-(4'-Benzyloxyphenyl)thiomorpholin-5-one::CHEMBL598394

SMILES: O=C1CSC(CN1)c1ccc(OCc2ccccc2)cc1

InChI Key: InChIKey=WREDZZPMENXHRK-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50307363   

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] B (Homo sapiens (Human))	BDBM50307363 ((+/-)-2-(4'-Benzyloxyphenyl)thiomorpholin-5-one | ...) Show SMILES O=C1CSC(CN1)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C17H17NO2S/c19-17-12-21-16(10-18-17)14-6-8-15(9-7-14)20-11-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOB by spectrophotometrically				Bioorg Med Chem 18: 1388-95 (2010) Article DOI: 10.1016/j.bmc.2010.01.029 BindingDB Entry DOI: 10.7270/Q2T72JD7
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50307363 ((+/-)-2-(4'-Benzyloxyphenyl)thiomorpholin-5-one | ...) Show SMILES O=C1CSC(CN1)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C17H17NO2S/c19-17-12-21-16(10-18-17)14-6-8-15(9-7-14)20-11-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	74	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Inhibition of MAOB in rat brain mitochondrial suspension				Bioorg Med Chem 18: 1388-95 (2010) Article DOI: 10.1016/j.bmc.2010.01.029 BindingDB Entry DOI: 10.7270/Q2T72JD7
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50307363 ((+/-)-2-(4'-Benzyloxyphenyl)thiomorpholin-5-one | ...) Show SMILES O=C1CSC(CN1)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C17H17NO2S/c19-17-12-21-16(10-18-17)14-6-8-15(9-7-14)20-11-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,18,19)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.75E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Inhibition of MAOA in rat brain mitochondrial suspension				Bioorg Med Chem 18: 1388-95 (2010) Article DOI: 10.1016/j.bmc.2010.01.029 BindingDB Entry DOI: 10.7270/Q2T72JD7
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50307363 ((+/-)-2-(4'-Benzyloxyphenyl)thiomorpholin-5-one | ...) Show SMILES O=C1CSC(CN1)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C17H17NO2S/c19-17-12-21-16(10-18-17)14-6-8-15(9-7-14)20-11-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,18,19)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA by spectrophotometrically				Bioorg Med Chem 18: 1388-95 (2010) Article DOI: 10.1016/j.bmc.2010.01.029 BindingDB Entry DOI: 10.7270/Q2T72JD7
					More data for this Ligand-Target Pair