Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1/2/3/6' and Ligand = 'BDBM50239827'   

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 1/2/3/6 (Homo sapiens (Human))	BDBM50239827 (CHEMBL4090555) Show SMILES ONC(=O)CCCCCN(C(=O)c1ccccc1)C1(CCCCC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C26H39N3O4/c30-23(28-33)17-9-3-12-20-29(24(31)21-13-5-1-6-14-21)26(18-10-4-11-19-26)25(32)27-22-15-7-2-8-16-22/h1,5-6,13-14,22,33H,2-4,7-12,15-20H2,(H,27,32)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universit£t D£sseldorf Curated by ChEMBL					Assay Description Inhibition of HDAC1/2/3/6 in human A2780cisR cells using Boc-Lys(epsilon-Ac)-AMC as substrate preincubated for 18 hrs followed by substrate addition ...				J Med Chem 60: 5493-5506 (2017) Article DOI: 10.1021/acs.jmedchem.7b00197 BindingDB Entry DOI: 10.7270/Q20P125Z
					More data for this Ligand-Target Pair
Histone deacetylase 1/2/3/6 (Homo sapiens (Human))	BDBM50239827 (CHEMBL4090555) Show SMILES ONC(=O)CCCCCN(C(=O)c1ccccc1)C1(CCCCC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C26H39N3O4/c30-23(28-33)17-9-3-12-20-29(24(31)21-13-5-1-6-14-21)26(18-10-4-11-19-26)25(32)27-22-15-7-2-8-16-22/h1,5-6,13-14,22,33H,2-4,7-12,15-20H2,(H,27,32)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universit£t D£sseldorf Curated by ChEMBL					Assay Description Inhibition of HDAC1/2/3/6 in human Cal27CisR cells using Boc-Lys(epsilon-Ac)-AMC as substrate preincubated for 18 hrs followed by substrate addition ...				J Med Chem 60: 5493-5506 (2017) Article DOI: 10.1021/acs.jmedchem.7b00197 BindingDB Entry DOI: 10.7270/Q20P125Z
					More data for this Ligand-Target Pair
Histone deacetylase 1/2/3/6 (Homo sapiens (Human))	BDBM50239827 (CHEMBL4090555) Show SMILES ONC(=O)CCCCCN(C(=O)c1ccccc1)C1(CCCCC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C26H39N3O4/c30-23(28-33)17-9-3-12-20-29(24(31)21-13-5-1-6-14-21)26(18-10-4-11-19-26)25(32)27-22-15-7-2-8-16-22/h1,5-6,13-14,22,33H,2-4,7-12,15-20H2,(H,27,32)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universit£t D£sseldorf Curated by ChEMBL					Assay Description Inhibition of HDAC1/2/3/6 in human A2780 cells using Boc-Lys(epsilon-Ac)-AMC as substrate preincubated for 18 hrs followed by substrate addition meas...				J Med Chem 60: 5493-5506 (2017) Article DOI: 10.1021/acs.jmedchem.7b00197 BindingDB Entry DOI: 10.7270/Q20P125Z
					More data for this Ligand-Target Pair
Histone deacetylase 1/2/3/6 (Homo sapiens (Human))	BDBM50239827 (CHEMBL4090555) Show SMILES ONC(=O)CCCCCN(C(=O)c1ccccc1)C1(CCCCC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C26H39N3O4/c30-23(28-33)17-9-3-12-20-29(24(31)21-13-5-1-6-14-21)26(18-10-4-11-19-26)25(32)27-22-15-7-2-8-16-22/h1,5-6,13-14,22,33H,2-4,7-12,15-20H2,(H,27,32)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universit£t D£sseldorf Curated by ChEMBL					Assay Description Inhibition of HDAC1/2/3/6 in human Cal27 cells using Boc-Lys(epsilon-Ac)-AMC as substrate preincubated for 18 hrs followed by substrate addition meas...				J Med Chem 60: 5493-5506 (2017) Article DOI: 10.1021/acs.jmedchem.7b00197 BindingDB Entry DOI: 10.7270/Q20P125Z
					More data for this Ligand-Target Pair