BDBM50155318 CHEMBL3781063

SMILES: CSc1ccc(cc1)C(=O)\C=C\c1cccc2OCOc12

InChI Key: InChIKey=SSGWAVHPYJIKAN-HJWJTTGWSA-N

Data: 1 KI  1 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 = 50155318   

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))	BDBM50155318 (CHEMBL3781063) Show SMILES CSc1ccc(cc1)C(=O)\C=C\c1cccc2OCOc12 Show InChI InChI=1S/C19H25N3O2/c23-18(14-6-3-9-20-12-14)17-8-4-10-22(17)19(24)16-11-13-5-1-2-7-15(13)21-16/h3,6,9,12-13,15-17,21H,1-2,4-5,7-8,10-11H2/t13-,15-,16-,17-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Qatar University Curated by ChEMBL					Assay Description Competitive inhibition of human MAOB overexpressed in Pichia pastoris using MMTP as substrate preincubated for 5 mins followed by substrate addition ...				Eur J Med Chem 114: 162-9 (2016) BindingDB Entry DOI: 10.7270/Q2N018F1
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50155318 (CHEMBL3781063) Show SMILES CSc1ccc(cc1)C(=O)\C=C\c1cccc2OCOc12 Show InChI InChI=1S/C19H25N3O2/c23-18(14-6-3-9-20-12-14)17-8-4-10-22(17)19(24)16-11-13-5-1-2-7-15(13)21-16/h3,6,9,12-13,15-17,21H,1-2,4-5,7-8,10-11H2/t13-,15-,16-,17-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
Qatar University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAOB expressed in baculovirus infected BTI insect cell microsomes using MMTP as substrate preincubated for 5 mins fol...				Eur J Med Chem 114: 162-9 (2016) BindingDB Entry DOI: 10.7270/Q2N018F1
					More data for this Ligand-Target Pair