Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50372466'   

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))	BDBM50372466 (CHEMBL272840) Show SMILES CC(=O)CCCCC[C@H](NC(=O)c1cnns1)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1 Show InChI InChI=1S/C28H31N5O3S/c1-19(34)10-4-2-7-15-24(32-28(36)25-18-30-33-37-25)27(35)29-17-16-22-21-13-8-9-14-23(21)31-26(22)20-11-5-3-6-12-20/h3,5-6,8-9,11-14,18,24,31H,2,4,7,10,15-17H2,1H3,(H,29,35)(H,32,36)/t24-/m0/s1	PDB MMDB 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	480	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche Curated by ChEMBL					Assay Description Inhibition of human HDAC1				J Med Chem 51: 1505-29 (2008) Article DOI: 10.1021/jm7011408 BindingDB Entry DOI: 10.7270/Q2M32WMT
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50372466 (CHEMBL272840) Show SMILES CC(=O)CCCCC[C@H](NC(=O)c1cnns1)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1 Show InChI InChI=1S/C28H31N5O3S/c1-19(34)10-4-2-7-15-24(32-28(36)25-18-30-33-37-25)27(35)29-17-16-22-21-13-8-9-14-23(21)31-26(22)20-11-5-3-6-12-20/h3,5-6,8-9,11-14,18,24,31H,2,4,7,10,15-17H2,1H3,(H,29,35)(H,32,36)/t24-/m0/s1	PDB MMDB 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	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche Curated by ChEMBL					Assay Description Inhibition of HDAC1 from human HeLa cells				J Med Chem 51: 1505-29 (2008) Article DOI: 10.1021/jm7011408 BindingDB Entry DOI: 10.7270/Q2M32WMT
					More data for this Ligand-Target Pair