Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50477743'   

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))	BDBM50477743 (CHEMBL249382) Show SMILES ONC(=O)CCC1=CCCN(Cc2ccc(cc2)[N+]([O-])=O)C1=O |t:6| Show InChI InChI=1S/C15H17N3O5/c19-14(16-21)8-5-12-2-1-9-17(15(12)20)10-11-3-6-13(7-4-11)18(22)23/h2-4,6-7,21H,1,5,8-10H2,(H,16,19)	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	230	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Inhibition of HDAC in HeLa cell lysates				Bioorg Med Chem Lett 17: 6234-8 (2007) Article DOI: 10.1016/j.bmcl.2007.09.034 BindingDB Entry DOI: 10.7270/Q2RN3BMB
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