BDBM50236510 CHEMBL4071459

SMILES: Cn1c(cc2sccc12)C(=O)Nc1ccccc1COc1ccc(NC2CCNCC2)cc1

InChI Key: InChIKey=NYQXQBQGBFHCIU-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50236510   

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
LSD1/CoREST complex (Homo sapiens (Human))	BDBM50236510 (CHEMBL4071459) Show SMILES Cn1c(cc2sccc12)C(=O)Nc1ccccc1COc1ccc(NC2CCNCC2)cc1 Show InChI InChI=1S/C26H28N4O2S/c1-30-23-12-15-33-25(23)16-24(30)26(31)29-22-5-3-2-4-18(22)17-32-21-8-6-19(7-9-21)28-20-10-13-27-14-11-20/h2-9,12,15-16,20,27-28H,10-11,13-14,17H2,1H3,(H,29,31)	PDB MMDB UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
European Institute of Oncology Curated by ChEMBL					Assay Description Inhibition of recombinant human KDM1A/CoREST complex expressed in Escherichia coli using [Lys(Me1)4]-Histone H3 (1 to 21 residues)-GGK(biotin) as sub...				J Med Chem 60: 1693-1715 (2017) Article DOI: 10.1021/acs.jmedchem.6b01019 BindingDB Entry DOI: 10.7270/Q22809VX
					More data for this Ligand-Target Pair