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SMILES: OC(=O)CCCCC[C@H](NC(=O)c1cncs1)c1nc(c[nH]1)-c1ccc2ccccc2c1

InChI Key: InChIKey=BKXXNYSAKGLZLY-IBGZPJMESA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50258582   
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


(Homo sapiens (Human))		BDBM50258582
PNG
((S)-7-(5-(naphthalen-2-yl)-1H-imidazol-2-yl)-7-(th...)
Show SMILES OC(=O)CCCCC[C@H](NC(=O)c1cncs1)c1nc(c[nH]1)-c1ccc2ccccc2c1 |r|
Show InChI InChI=1S/C24H24N4O3S/c29-22(30)9-3-1-2-8-19(28-24(31)21-14-25-15-32-21)23-26-13-20(27-23)18-11-10-16-6-4-5-7-17(16)12-18/h4-7,10-15,19H,1-3,8-9H2,(H,26,27)(H,28,31)(H,29,30)/t19-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



IRBM/Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of C-terminal FLAG tagged HDAC1 (unknown origin)

Bioorg Med Chem Lett 19: 3081-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.011
BindingDB Entry DOI: 10.7270/Q2P84BSJ
More data for this
Ligand-Target Pair