BDBM50258624 (S)-7-(1-methylpiperidine-4-carboxamido)-7-(5-(naphthalen-2-yl)-1H-imidazol-2-yl)heptanoic acid::CHEMBL466013

SMILES: CN1CCC(CC1)C(=O)N[C@@H](CCCCCC(O)=O)c1nc(c[nH]1)-c1ccc2ccccc2c1

InChI Key: InChIKey=OLNLBOUAKHUUNL-QHCPKHFHSA-N

Data: 1 IC50

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 1 hit for monomerid = 50258624   

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 (Homo sapiens (Human))	BDBM50258624 ((S)-7-(1-methylpiperidine-4-carboxamido)-7-(5-(nap...) Show SMILES CN1CCC(CC1)C(=O)N[C@@H](CCCCCC(O)=O)c1nc(c[nH]1)-c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C27H34N4O3/c1-31-15-13-20(14-16-31)27(34)30-23(9-3-2-4-10-25(32)33)26-28-18-24(29-26)22-12-11-19-7-5-6-8-21(19)17-22/h5-8,11-12,17-18,20,23H,2-4,9-10,13-16H2,1H3,(H,28,29)(H,30,34)(H,32,33)/t23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
IRBM/Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of C-terminal FLAG tagged HDAC1 (unknown origin)				Bioorg Med Chem Lett 19: 3081-4 (2009) Article DOI: 10.1016/j.bmcl.2009.04.011 BindingDB Entry DOI: 10.7270/Q2P84BSJ
					More data for this Ligand-Target Pair