BDBM50137839 6-(5-Hydroxy-1,3-dioxo-6-piperidin-1-ylmethyl-1H,3H-benzo[de]isoquinolin-2-yl)-hexanoic acid (2-amino-phenyl)-amide::CHEMBL329745

SMILES: Nc1ccccc1NC(=O)CCCCCN1C(=O)c2cccc3c(CN4CCCCC4)c(O)cc(C1=O)c23

InChI Key: InChIKey=ICTBILHZNDIZIF-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50137839   

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 (Homo sapiens (Human))	BDBM50137839 (6-(5-Hydroxy-1,3-dioxo-6-piperidin-1-ylmethyl-1H,3...) Show SMILES Nc1ccccc1NC(=O)CCCCCN1C(=O)c2cccc3c(CN4CCCCC4)c(O)cc(C1=O)c23 Show InChI InChI=1S/C30H34N4O4/c31-24-12-4-5-13-25(24)32-27(36)14-3-1-8-17-34-29(37)21-11-9-10-20-23(19-33-15-6-2-7-16-33)26(35)18-22(28(20)21)30(34)38/h4-5,9-13,18,35H,1-3,6-8,14-17,19,31H2,(H,32,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Effect on induced hyperacetylation of histones in whole cells				Bioorg Med Chem Lett 14: 283-7 (2003) BindingDB Entry DOI: 10.7270/Q2BV7G17
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50137839 (6-(5-Hydroxy-1,3-dioxo-6-piperidin-1-ylmethyl-1H,3...) Show SMILES Nc1ccccc1NC(=O)CCCCCN1C(=O)c2cccc3c(CN4CCCCC4)c(O)cc(C1=O)c23 Show InChI InChI=1S/C30H34N4O4/c31-24-12-4-5-13-25(24)32-27(36)14-3-1-8-17-34-29(37)21-11-9-10-20-23(19-33-15-6-2-7-16-33)26(35)18-22(28(20)21)30(34)38/h4-5,9-13,18,35H,1-3,6-8,14-17,19,31H2,(H,32,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Ability to inhibit recombinant human histone deacetylase 1 (HDAC-1).				Bioorg Med Chem Lett 14: 283-7 (2003) BindingDB Entry DOI: 10.7270/Q2BV7G17
					More data for this Ligand-Target Pair