Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 3' and Ligand = 'BDBM50102496'   

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
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50102496 (CHEMBL3339034) Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Cl)ncnc2s1 Show InChI InChI=1S/C14H17ClN4O3S/c15-13-9-7-12(23-14(9)17-8-16-13)18-10(20)5-3-1-2-4-6-11(21)19-22/h7-8,22H,1-6H2,(H,18,20)(H,19,21)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
The Walter and Eliza Hall Institute of Medical Research Curated by ChEMBL					Assay Description Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins				Bioorg Med Chem 22: 6146-55 (2014) Article DOI: 10.1016/j.bmc.2014.08.030 BindingDB Entry DOI: 10.7270/Q2VQ34F7
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