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SMILES: ONC(=O)\C=C\c1ccc(CNC(=O)c2ccc(cc2)N2CCCC2)cc1

InChI Key: InChIKey=JKVNVKOVLBVYHQ-KPKJPENVSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50474470   
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 1/2/3/4/5/6/7/8/9/11/Polyamine deacetylase HDAC10


(Homo sapiens (Human))		BDBM50474470
PNG
(CHEMBL152543 | SK-7068)
Show SMILES ONC(=O)\C=C\c1ccc(CNC(=O)c2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C21H23N3O3/c25-20(23-27)12-7-16-3-5-17(6-4-16)15-22-21(26)18-8-10-19(11-9-18)24-13-1-2-14-24/h3-12,27H,1-2,13-15H2,(H,22,26)(H,23,25)/b12-7+
PDB

UniProtKB/SwissProt

antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 205n/an/an/an/an/an/a



In2Gen Co. Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against Histone deacetylase (HDAC) from SNU-16 (human gastric adenocarcinoma) cells

J Med Chem 46: 5745-51 (2003)


Article DOI: 10.1021/jm030377q
BindingDB Entry DOI: 10.7270/Q2639SGQ
More data for this
Ligand-Target Pair