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SMILES: ONC(=O)CCCCCN(C(C(=O)NC1CCCCC1)c1ccccc1)C(=O)c1ccccc1

InChI Key: InChIKey=ZJCFLUSNOIDJBF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50239828   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50239828 (CHEMBL4100732) Show SMILES ONC(=O)CCCCCN(C(C(=O)NC1CCCCC1)c1ccccc1)C(=O)c1ccccc1 Show InChI InChI=1S/C27H35N3O4/c31-24(29-34)19-11-4-12-20-30(27(33)22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)26(32)28-23-17-9-3-10-18-23/h1-2,5-8,13-16,23,25,34H,3-4,9-12,17-20H2,(H,28,32)(H,29,31)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.92E+3	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))	BDBM50239828 (CHEMBL4100732) Show SMILES ONC(=O)CCCCCN(C(C(=O)NC1CCCCC1)c1ccccc1)C(=O)c1ccccc1 Show InChI InChI=1S/C27H35N3O4/c31-24(29-34)19-11-4-12-20-30(27(33)22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)26(32)28-23-17-9-3-10-18-23/h1-2,5-8,13-16,23,25,34H,3-4,9-12,17-20H2,(H,28,32)(H,29,31)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.14E+3	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))	BDBM50239828 (CHEMBL4100732) Show SMILES ONC(=O)CCCCCN(C(C(=O)NC1CCCCC1)c1ccccc1)C(=O)c1ccccc1 Show InChI InChI=1S/C27H35N3O4/c31-24(29-34)19-11-4-12-20-30(27(33)22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)26(32)28-23-17-9-3-10-18-23/h1-2,5-8,13-16,23,25,34H,3-4,9-12,17-20H2,(H,28,32)(H,29,31)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.06E+3	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
Histone deacetylase 1/2/3/6 (Homo sapiens (Human))	BDBM50239828 (CHEMBL4100732) Show SMILES ONC(=O)CCCCCN(C(C(=O)NC1CCCCC1)c1ccccc1)C(=O)c1ccccc1 Show InChI InChI=1S/C27H35N3O4/c31-24(29-34)19-11-4-12-20-30(27(33)22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)26(32)28-23-17-9-3-10-18-23/h1-2,5-8,13-16,23,25,34H,3-4,9-12,17-20H2,(H,28,32)(H,29,31)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.65E+3	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