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BDBM50156767 3-(3-(4-(phenoxymethyl)phenyl)ureido)benzoic acid::CHEMBL224844

SMILES: OC(=O)c1cccc(NC(=O)Nc2ccc(COc3ccccc3)cc2)c1

InChI Key: InChIKey=VTTXQJYYGCSRQS-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50156767   
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
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (Human))
BDBM50156767
PNG
(3-(3-(4-(phenoxymethyl)phenyl)ureido)benzoic acid ...)
Show SMILES OC(=O)c1cccc(NC(=O)Nc2ccc(COc3ccccc3)cc2)c1
Show InChI InChI=1S/C21H18N2O4/c24-20(25)16-5-4-6-18(13-16)23-21(26)22-17-11-9-15(10-12-17)14-27-19-7-2-1-3-8-19/h1-13H,14H2,(H,24,25)(H2,22,23,26)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



University of Kuopio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay


J Med Chem 47: 6292-8 (2004)


Article DOI: 10.1021/jm049933m
BindingDB Entry DOI: 10.7270/Q2S1820Z
More data for this
Ligand-Target Pair