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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50196593'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Histone deacetylase 1


(Homo sapiens (Human))		BDBM50196593
PNG
(CHEMBL387042 | N-hydroxy-7-(4-((3-hydroxy-5-(hydro...)
Show SMILES Cc1ncc(CO)c(CNc2ccc(OCCCCCCC(=O)NO)cc2)c1O
Show InChI InChI=1S/C21H29N3O5/c1-15-21(27)19(16(14-25)12-22-15)13-23-17-7-9-18(10-8-17)29-11-5-3-2-4-6-20(26)24-28/h7-10,12,23,25,27-28H,2-6,11,13-14H2,1H3,(H,24,26)
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Article
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n/an/a 22n/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