Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50226109'   

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 1 (Homo sapiens (Human))	BDBM50226109 (CHEMBL401449 | N-(2-aminophenyl)-4-((2,4-dioxo-1,2...) Show SMILES Nc1ccccc1NC(=O)c1ccc(Cn2c(=O)[nH]c3ccsc3c2=O)cc1 Show InChI InChI=1S/C20H16N4O3S/c21-14-3-1-2-4-15(14)22-18(25)13-7-5-12(6-8-13)11-24-19(26)17-16(9-10-28-17)23-20(24)27/h1-10H,11,21H2,(H,22,25)(H,23,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1 expressed in insect Sf9 cells				Bioorg Med Chem Lett 17: 6729-33 (2007) Article DOI: 10.1016/j.bmcl.2007.10.050 BindingDB Entry DOI: 10.7270/Q2V124J9
					More data for this Ligand-Target Pair