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SMILES: CC(=O)Nc1c(CCc2ccccc2)oc2c(Br)cc(Cl)cc2c1=O

InChI Key: InChIKey=ORPJTTYDGIUYCH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50032647   
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
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))		BDBM50032647
PNG
(CHEMBL3354221)
Show SMILES CC(=O)Nc1c(CCc2ccccc2)oc2c(Br)cc(Cl)cc2c1=O
Show InChI InChI=1S/C19H15BrClNO3/c1-11(23)22-17-16(8-7-12-5-3-2-4-6-12)25-19-14(18(17)24)9-13(21)10-15(19)20/h2-6,9-10H,7-8H2,1H3,(H,22,23)
PDB
MMDB

NCI pathway
KEGG

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antibodypedia
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PC cid
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UniChem

Similars
Article
PubMed
n/an/a 2.87E+4n/an/an/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant GST-tagged sirtuin-2 (unknown origin) using KI179 as substrate after 1 hr by fluorescence assay

J Med Chem 57: 9870-88 (2014)


Article DOI: 10.1021/jm500930h
BindingDB Entry DOI: 10.7270/Q2ST7RG2
More data for this
Ligand-Target Pair