new BindingDB logo
myBDB logout

BDBM50196595 6-(4-(2-(1H-indol-3-yl)acetamido)phenyl1H-indol-3-yl)acetamido)phenoxy)-N-hydroxyhexanamide::CHEMBL216062

SMILES: ONC(=O)CCCCCOc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

InChI Key: InChIKey=VDRPQSGKHAWSGH-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 = 50196595   
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 1


(Homo sapiens (Human))
BDBM50196595
PNG
(6-(4-(2-(1H-indol-3-yl)acetamido)phenyl1H-indol-3-...)
Show SMILES ONC(=O)CCCCCOc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1
Show InChI InChI=1S/C22H25N3O4/c26-21(25-28)8-2-1-5-13-29-18-11-9-17(10-12-18)24-22(27)14-16-15-23-20-7-4-3-6-19(16)20/h3-4,6-7,9-12,15,23,28H,1-2,5,8,13-14H2,(H,24,27)(H,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 50n/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibition of histone deacetylase activity using HeLa cell nuclear extract as enzyme source


Bioorg Med Chem Lett 17: 136-41 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.085
BindingDB Entry DOI: 10.7270/Q2B56JDQ
More data for this
Ligand-Target Pair