BDBM50439671 CHEMBL2417784

SMILES: C[C@@H](S)C(=O)NCCCCCNC(=O)c1c(C)onc1-c1ccccc1

InChI Key: InChIKey=IMIDYBQMXWFUIG-CQSZACIVSA-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 = 50439671   

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 3 (Homo sapiens (Human))	BDBM50439671 (CHEMBL2417784) Show SMILES C[C@@H](S)C(=O)NCCCCCNC(=O)c1c(C)onc1-c1ccccc1 |r| Show InChI InChI=1S/C19H25N3O3S/c1-13-16(17(22-25-13)15-9-5-3-6-10-15)19(24)21-12-8-4-7-11-20-18(23)14(2)26/h3,5-6,9-10,14,26H,4,7-8,11-12H2,1-2H3,(H,20,23)(H,21,24)/t14-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC3 (unknown origin)				J Med Chem 56: 6297-313 (2013) Article DOI: 10.1021/jm4001659 BindingDB Entry DOI: 10.7270/Q29G5P7J
					More data for this Ligand-Target Pair