BDBM50236449 CHEMBL4074371

SMILES: Cn1c(cc2sccc12)C(=O)Nc1ccccc1OCC1CCN(CC2CCNCC2)CC1

InChI Key: InChIKey=ILTIJVZNOCXXGD-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 = 50236449   

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))	BDBM50236449 (CHEMBL4074371) Show SMILES Cn1c(cc2sccc12)C(=O)Nc1ccccc1OCC1CCN(CC2CCNCC2)CC1 Show InChI InChI=1S/C26H34N4O2S/c1-29-22-10-15-33-25(22)16-23(29)26(31)28-21-4-2-3-5-24(21)32-18-20-8-13-30(14-9-20)17-19-6-11-27-12-7-19/h2-5,10,15-16,19-20,27H,6-9,11-14,17-18H2,1H3,(H,28,31)	PDB MMDB UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+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
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