BDBM50526188 CHEMBL4451461

SMILES: CNCCN(C)c1cc(C)nc2nc(SCc3ccccc3)nn12

InChI Key: InChIKey=XWTORNWOBITNIF-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50526188   

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))	BDBM50526188 (CHEMBL4451461) Show SMILES CNCCN(C)c1cc(C)nc2nc(SCc3ccccc3)nn12 Show InChI InChI=1S/C17H22N6S/c1-13-11-15(22(3)10-9-18-2)23-16(19-13)20-17(21-23)24-12-14-7-5-4-6-8-14/h4-8,11,18H,9-10,12H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhengzhou University Curated by ChEMBL					Assay Description Inhibition of recombinant LSD1 (unknown origin) using H3K4me2 as substrate by fluorescence assay				Eur J Med Chem 166: 432-444 (2019) Article DOI: 10.1016/j.ejmech.2019.01.075
					More data for this Ligand-Target Pair