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BDBM50382289 CHEMBL2022536

SMILES: CC(=O)NCCCO[C@@H](CN)c1cc(Br)c(OS(O)(=O)=O)c(Br)c1

InChI Key: InChIKey=LUKTVGRPGJKVIG-STGVRZAANA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50382289   
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
Kynurenine 3-monooxygenase


(Rattus norvegicus)
BDBM50382289
PNG
(CHEMBL2022536)
Show SMILES CC(=O)NCCCO[C@@H](CN)c1cc(Br)c(OS(O)(=O)=O)c(Br)c1
Show InChI InChI=1/C13H18Br2N2O6S/c1-8(18)17-3-2-4-22-12(7-16)9-5-10(14)13(11(15)6-9)23-24(19,20)21/h5-6,12H,2-4,7,16H2,1H3,(H,17,18)(H,19,20,21)/t12-/s2
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CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of kynurenine-3-hydroxylase in rat liver homogenates assessed as effect on production of 3-hydroxy kynurenine incubated for 1 hr by HPLC


Bioorg Med Chem Lett 22: 3398-401 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.002
BindingDB Entry DOI: 10.7270/Q23N24FB
More data for this
Ligand-Target Pair