Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50285613'   

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 (Homo sapiens (Human))	BDBM50285613 (CHEMBL4172024) Show SMILES Cl.NCCCNCCNCCCn1c(=O)c2ccc3c4c(ccc(c24)c1=O)c(=O)n(CCCCCC(=O)NO)c3=O Show InChI InChI=1S/C28H36N6O6/c29-11-4-12-30-14-15-31-13-5-17-34-27(38)20-9-7-18-23-19(8-10-21(24(20)23)28(34)39)26(37)33(25(18)36)16-3-1-2-6-22(35)32-40/h7-10,30-31,40H,1-6,11-17,29H2,(H,32,35)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Inhibition of HDAC in human HeLa nuclear extract using Fluor de Lys as substrate by fluorimetric method				ACS Med Chem Lett 8: 1218-1223 (2017) Article DOI: 10.1021/acsmedchemlett.7b00289 BindingDB Entry DOI: 10.7270/Q22N54T3
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