BindingDB logo
myBDB logout

null

SMILES: ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)NCc1ccccc1

InChI Key: InChIKey=ISQBQFFWLLUKJK-KRWDZBQOSA-N

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 = 50308287   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Histone deacetylase 8


(Homo sapiens (Human))		BDBM50308287
PNG
((S)-N-Benzyl-7-(2-(hydroxyamino)-2-oxoethoxy)-1,2,...)
Show SMILES ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C19H21N3O4/c23-18(22-25)12-26-16-7-6-14-9-17(20-11-15(14)8-16)19(24)21-10-13-4-2-1-3-5-13/h1-8,17,20,25H,9-12H2,(H,21,24)(H,22,23)/t17-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 5.10E+3n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of HDAC8 expressed in Escherichia coli assessed as Boc-Lys (acetyl)-AMC substrate hydrolysis by fluorimetric assay

Bioorg Med Chem 18: 1761-72 (2010)


Article DOI: 10.1016/j.bmc.2010.01.060
BindingDB Entry DOI: 10.7270/Q2JD4WX3
More data for this
Ligand-Target Pair