BDBM50065384 CHEMBL3401325

SMILES: Cl.S=C(NCCCNCCCCCNCCCNC(=S)NC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1

InChI Key: InChIKey=DAULESOQOUCCBS-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50065384   

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
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50065384 (CHEMBL3401325) Show SMILES Cl.S=C(NCCCNCCCCCNCCCNC(=S)NC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C39H50N6S2.ClH/c46-38(44-36(32-18-6-1-7-19-32)33-20-8-2-9-21-33)42-30-16-28-40-26-14-5-15-27-41-29-17-31-43-39(47)45-37(34-22-10-3-11-23-34)35-24-12-4-13-25-35;/h1-4,6-13,18-25,36-37,40-41H,5,14-17,26-31H2,(H2,42,44,46)(H2,43,45,47);1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
John Hopkins University Curated by ChEMBL					Assay Description Inhibition of human recombinant LSD1 after 30 mins to 4 hrs by fluorescence assay				Bioorg Med Chem 23: 1601-12 (2015) Article DOI: 10.1016/j.bmc.2015.01.049 BindingDB Entry DOI: 10.7270/Q25Q4XSD
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50065384 (CHEMBL3401325) Show SMILES Cl.S=C(NCCCNCCCCCNCCCNC(=S)NC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C39H50N6S2.ClH/c46-38(44-36(32-18-6-1-7-19-32)33-20-8-2-9-21-33)42-30-16-28-40-26-14-5-15-27-41-29-17-31-43-39(47)45-37(34-22-10-3-11-23-34)35-24-12-4-13-25-35;/h1-4,6-13,18-25,36-37,40-41H,5,14-17,26-31H2,(H2,42,44,46)(H2,43,45,47);1H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
John Hopkins University Curated by ChEMBL					Assay Description Inhibition of MAO-B (unknown origin) by MAo-Glo kit analysis				Bioorg Med Chem 23: 1601-12 (2015) Article DOI: 10.1016/j.bmc.2015.01.049 BindingDB Entry DOI: 10.7270/Q25Q4XSD
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50065384 (CHEMBL3401325) Show SMILES Cl.S=C(NCCCNCCCCCNCCCNC(=S)NC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C39H50N6S2.ClH/c46-38(44-36(32-18-6-1-7-19-32)33-20-8-2-9-21-33)42-30-16-28-40-26-14-5-15-27-41-29-17-31-43-39(47)45-37(34-22-10-3-11-23-34)35-24-12-4-13-25-35;/h1-4,6-13,18-25,36-37,40-41H,5,14-17,26-31H2,(H2,42,44,46)(H2,43,45,47);1H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
John Hopkins University Curated by ChEMBL					Assay Description Inhibition of MAO-A (unknown origin) by MAo-Glo kit analysis				Bioorg Med Chem 23: 1601-12 (2015) Article DOI: 10.1016/j.bmc.2015.01.049 BindingDB Entry DOI: 10.7270/Q25Q4XSD
					More data for this Ligand-Target Pair