BDBM242906 US9428447, DK-319

SMILES: CCC(CC)(c1ccc(OCCCCCC(=O)NO)c(C)c1)c1ccc(OCC(O)C(C)(C)C)c(C)c1

InChI Key: InChIKey=NTXLUTRMOLQGEP-UHFFFAOYSA-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 = 242906   

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 6 (Homo sapiens (Human))	BDBM242906 (US9428447, DK-319) Show SMILES CCC(CC)(c1ccc(OCCCCCC(=O)NO)c(C)c1)c1ccc(OCC(O)C(C)(C)C)c(C)c1 |w:28.29| Show InChI InChI=1S/C31H47NO5/c1-8-31(9-2,25-15-17-27(23(4)20-25)37-21-28(33)30(5,6)7)24-14-16-26(22(3)19-24)36-18-12-10-11-13-29(34)32-35/h14-17,19-20,28,33,35H,8-13,18,21H2,1-7H3,(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.65E+3	n/a	n/a	n/a	n/a	8.1	37
The Royal Institution for the Advancement of Learning/McGill University US Patent					Assay Description Boc-Lys(Ac)-7-amino-4-methylcoumarin (Boc-Lys(Ac)-AMC) was used as substrate for the HDAC assays. Substrate solution was prepared as follow: Boc(Lys-...				US Patent US9428447 (2016) BindingDB Entry DOI: 10.7270/Q2TX3D9H
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