BindingDB logo
myBDB logout

BDBM50498400 CHEMBL3594201

SMILES: ONC(=O)CCCCCC(=O)NCc1cc(C(=O)NCc2ccccc2)c2ccccc2n1

InChI Key: InChIKey=APNNETGGCDTVPX-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 = 50498400   
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 1/2


(Homo sapiens (Human))
BDBM50498400
PNG
(CHEMBL3594201)
Show SMILES ONC(=O)CCCCCC(=O)NCc1cc(C(=O)NCc2ccccc2)c2ccccc2n1
Show InChI InChI=1S/C25H28N4O4/c30-23(13-5-2-6-14-24(31)29-33)26-17-19-15-21(20-11-7-8-12-22(20)28-19)25(32)27-16-18-9-3-1-4-10-18/h1,3-4,7-12,15,33H,2,5-6,13-14,16-17H2,(H,26,30)(H,27,32)(H,29,31)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 399n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of HDAC1/2 in human HeLa cell nuclear extracts preincubated for 5 mins followed by substrate addition measured after 0.5 hrs by Color de L...


Bioorg Med Chem 23: 4364-4374 (2015)


Article DOI: 10.1016/j.bmc.2015.06.024
BindingDB Entry DOI: 10.7270/Q2JQ1419
More data for this
Ligand-Target Pair