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SMILES: Cn1cc(CCN2CCN(C2=O)c2ccc(cc2)C(=O)NO)c2ccccc12

InChI Key: InChIKey=BVAIHWIQNZXZHM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50024680   
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))		BDBM50024680
PNG
(CHEMBL3335008)
Show SMILES Cn1cc(CCN2CCN(C2=O)c2ccc(cc2)C(=O)NO)c2ccccc12
Show InChI InChI=1S/C21H22N4O3/c1-23-14-16(18-4-2-3-5-19(18)23)10-11-24-12-13-25(21(24)27)17-8-6-15(7-9-17)20(26)22-28/h2-9,14,28H,10-13H2,1H3,(H,22,26)
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n/an/a 4n/an/an/an/an/an/a



Shanghai Huilun Life Sciences& Technology Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of HDAC1 (unknown origin) using Boc-Lys(Ac)-AMC as substrate by fluorescence assay

Bioorg Med Chem Lett 24: 4768-72 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.080
BindingDB Entry DOI: 10.7270/Q2J67JG6
More data for this
Ligand-Target Pair