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SMILES: CN(C)CCn1c(nc2cc(\C=C\C(=O)NO)ccc12)C1CC1c1ccccc1

InChI Key: InChIKey=KKLRZFCXMVBPRB-PKNBQFBNSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50353249   
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))		BDBM50353249
PNG
(CHEMBL1830412)
Show SMILES CN(C)CCn1c(nc2cc(\C=C\C(=O)NO)ccc12)C1CC1c1ccccc1
Show InChI InChI=1S/C23H26N4O2/c1-26(2)12-13-27-21-10-8-16(9-11-22(28)25-29)14-20(21)24-23(27)19-15-18(19)17-6-4-3-5-7-17/h3-11,14,18-19,29H,12-13,15H2,1-2H3,(H,25,28)/b11-9+
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n/an/a 175n/an/an/an/an/an/a



S*BIO Pte Ltd.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant HDAC1 using Fluor de Lys as substrate by fluorescence assay

J Med Chem 54: 4694-720 (2011)


Article DOI: 10.1021/jm2003552
BindingDB Entry DOI: 10.7270/Q29S1RD6
More data for this
Ligand-Target Pair