Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Lysine-specific demethylase 6B' and Ligand = 'BDBM50140348'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Lysine-specific demethylase 6B (Homo sapiens (Human))	BDBM50140348 (CHEMBL3754052) Show SMILES OC(=O)CCNc1nc(cc(n1)-n1ccnn1)N1CCN(CC1)c1ccc(F)cc1 Show InChI InChI=1S/C19H21FN8O2/c20-14-1-3-15(4-2-14)26-9-11-27(12-10-26)16-13-17(28-8-7-22-25-28)24-19(23-16)21-6-5-18(29)30/h1-4,7-8,13H,5-6,9-12H2,(H,29,30)(H,21,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of JMJD3 (unknown origin) using biotinylated H3K27me3 peptide as substrate after 1 hr by AlphaLISA assay				Bioorg Med Chem Lett 26: 721-5 (2016) Article DOI: 10.1016/j.bmcl.2016.01.006 BindingDB Entry DOI: 10.7270/Q2P55QC2
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