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SMILES: CN1CCN(Cc2ccccc2C(=O)\C=C\c2cccc(\C=C\C(=O)NO)n2)CC1

InChI Key: InChIKey=KCQAGTYGCFWNEX-WGDLNXRISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50481181   
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


(Homo sapiens (Human))		BDBM50481181
PNG
(CHEMBL584733)
Show SMILES CN1CCN(Cc2ccccc2C(=O)\C=C\c2cccc(\C=C\C(=O)NO)n2)CC1
Show InChI InChI=1S/C23H26N4O3/c1-26-13-15-27(16-14-26)17-18-5-2-3-8-21(18)22(28)11-9-19-6-4-7-20(24-19)10-12-23(29)25-30/h2-12,30H,13-17H2,1H3,(H,25,29)/b11-9+,12-10+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 53n/an/an/an/an/an/a



Congenia s.r.l.

Curated by ChEMBL


Assay Description
Inhibition of human HDAC extracted from human HeLa cells

J Med Chem 53: 822-39 (2010)


Article DOI: 10.1021/jm901502p
BindingDB Entry DOI: 10.7270/Q2CR5X5X
More data for this
Ligand-Target Pair