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SMILES: CCCCCNC(=O)[C@@H]1Cc2ccc(OCC(=O)NO)cc2CN1

InChI Key: InChIKey=PXKRKCFQCSHMOZ-HNNXBMFYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50308311   
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 8


(Homo sapiens (Human))		BDBM50308311
PNG
((S)-7-(2-(Hydroxyamino)-2-oxoethoxy)-N-pentyl-1,2,...)
Show SMILES CCCCCNC(=O)[C@@H]1Cc2ccc(OCC(=O)NO)cc2CN1 |r|
Show InChI InChI=1S/C17H25N3O4/c1-2-3-4-7-18-17(22)15-9-12-5-6-14(8-13(12)10-19-15)24-11-16(21)20-23/h5-6,8,15,19,23H,2-4,7,9-11H2,1H3,(H,18,22)(H,20,21)/t15-/m0/s1
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Similars
Article
PubMed
n/an/a 3.54E+3n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of HDAC8 expressed in Escherichia coli assessed as Boc-Lys (acetyl)-AMC substrate hydrolysis by fluorimetric assay

Bioorg Med Chem 18: 1761-72 (2010)


Article DOI: 10.1016/j.bmc.2010.01.060
BindingDB Entry DOI: 10.7270/Q2JD4WX3
More data for this
Ligand-Target Pair