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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kynureninase' and Ligand = 'BDBM50069729'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Kynureninase


(Rattus norvegicus)
BDBM50069729
PNG
(2-Amino-3-(2-amino-3-methoxy-benzenesulfonyl)-prop...)
Show SMILES COc1cccc(c1N)S(=O)(=O)CC(N)C(O)=O
Show InChI InChI=1S/C10H14N2O5S/c1-17-7-3-2-4-8(9(7)12)18(15,16)5-6(11)10(13)14/h2-4,6H,5,11-12H2,1H3,(H,13,14)
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a 2.90E+4n/an/an/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of mammalian kynureninase in rat liver


Bioorg Med Chem Lett 8: 133-8 (1999)


BindingDB Entry DOI: 10.7270/Q2639NXW
More data for this
Ligand-Target Pair