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SMILES: Cn1c2ccccc2c(=O)n(CCCCCC(=O)Nc2ccccc2N)c1=O

InChI Key: InChIKey=SMAYWZHSKYXLTQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50137840   
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))		BDBM50137840
PNG
(6-(1-Methyl-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-...)
Show SMILES Cn1c2ccccc2c(=O)n(CCCCCC(=O)Nc2ccccc2N)c1=O
Show InChI InChI=1S/C21H24N4O3/c1-24-18-12-7-4-9-15(18)20(27)25(21(24)28)14-8-2-3-13-19(26)23-17-11-6-5-10-16(17)22/h4-7,9-12H,2-3,8,13-14,22H2,1H3,(H,23,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



MethylGene Inc.

Curated by ChEMBL


Assay Description
Ability to inhibit recombinant human histone deacetylase 1 (HDAC-1).

Bioorg Med Chem Lett 14: 283-7 (2003)


BindingDB Entry DOI: 10.7270/Q2BV7G17
More data for this
Ligand-Target Pair