Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 3' and Ligand = 'BDBM50387326'   

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))	BDBM50387326 (CHEMBL2046616) Show SMILES ONC(=O)c1nc2CCN(CCCCNC(=O)\C=C\c3ccccc3)Cc2s1 Show InChI InChI=1S/C20H24N4O3S/c25-18(9-8-15-6-2-1-3-7-15)21-11-4-5-12-24-13-10-16-17(14-24)28-20(22-16)19(26)23-27/h1-3,6-9,27H,4-5,10-14H2,(H,21,25)(H,23,26)/b9-8+	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	2.64E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human recombinant His6-tagged and GST-fuses HDAC3 expressed in insect High5 cells using Ac-Lys-Tyr-Lys(e-acetyl)-AMC as substrate after...				Bioorg Med Chem Lett 22: 4540-5 (2012) Article DOI: 10.1016/j.bmcl.2012.05.123 BindingDB Entry DOI: 10.7270/Q2ZC83XG
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