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SMILES: ONC(=O)CCCCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NCc1ccccc1

InChI Key: InChIKey=OMYCWMZHYWUJMH-NRFANRHFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50213127   
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))		BDBM50213127
PNG
((S)-N-(1-(benzylamino)-8-(hydroxyamino)-1,8-dioxoo...)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C25H28N4O4/c30-23(29-33)14-6-2-5-13-21(24(31)26-17-18-9-3-1-4-10-18)28-25(32)22-16-15-19-11-7-8-12-20(19)27-22/h1,3-4,7-12,15-16,21,33H,2,5-6,13-14,17H2,(H,26,31)(H,28,32)(H,29,30)/t21-/m0/s1
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MMDB

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Article
PubMed
n/an/a 51.3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human HDAC 1

Bioorg Med Chem Lett 17: 3969-71 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.089
BindingDB Entry DOI: 10.7270/Q2M908CJ
More data for this
Ligand-Target Pair