Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 8' and Ligand = 'BDBM50239018'   

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 8 (Schistosoma mansoni)	BDBM50239018 (CHEMBL4071111) Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2cn(CCCCCC(=O)NO)c3ccccc23)c2ccccc12 |t:4| Show InChI InChI=1S/C27H26N4O4/c1-30-15-19(17-9-4-6-11-21(17)30)24-25(27(34)28-26(24)33)20-16-31(22-12-7-5-10-18(20)22)14-8-2-3-13-23(32)29-35/h4-7,9-12,15-16,35H,2-3,8,13-14H2,1H3,(H,29,32)(H,28,33,34)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni KDAC8 using (FAM)-labeled peptide as substrate after 60 mins by microfluidic assay				Bioorg Med Chem 25: 2105-2132 (2017) Article DOI: 10.1016/j.bmc.2017.02.020 BindingDB Entry DOI: 10.7270/Q2PG1V0C
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