BDBM50258326 (S)-3-(dimethylamino)-N-(1-(5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl)-7-oxooctyl)propanamide::CHEMBL2448568

SMILES: CCC(=O)CCCCC[C@H](NC(=O)CCN(C)C)c1ncc([nH]1)-c1cc(OC)c2ccccc2n1

InChI Key: InChIKey=CFPUYQVWXACGDO-NRFANRHFSA-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 = 50258326   

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))	BDBM50258326 ((S)-3-(dimethylamino)-N-(1-(5-(4-methoxyquinolin-2...) Show SMILES CCC(=O)CCCCC[C@H](NC(=O)CCN(C)C)c1ncc([nH]1)-c1cc(OC)c2ccccc2n1 |r| Show InChI InChI=1S/C26H35N5O3/c1-18(32)10-6-5-7-13-21(29-25(33)14-15-31(2)3)26-27-17-23(30-26)22-16-24(34-4)19-11-8-9-12-20(19)28-22/h8-9,11-12,16-17,21H,5-7,10,13-15H2,1-4H3,(H,27,30)(H,29,33)/t21-/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	51	n/a	n/a	n/a	n/a	n/a	n/a
IRBM/Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human C-terminal FLAG-tagged HDAC1 in HEK293 cells				J Med Chem 52: 3453-6 (2009) Article DOI: 10.1021/jm9004303 BindingDB Entry DOI: 10.7270/Q2Q24044
					More data for this Ligand-Target Pair