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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kynurenine 3-monooxygenase' and Ligand = 'BDBM50238008'   
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
Kynurenine 3-monooxygenase


(Homo sapiens (Human))
BDBM50238008
PNG
(CHEMBL4090020)
Show SMILES OC(=O)CCn1c2cc(Cl)ccc2[nH]c1=O
Show InChI InChI=1S/C10H9ClN2O3/c11-6-1-2-7-8(5-6)13(10(16)12-7)4-3-9(14)15/h1-2,5H,3-4H2,(H,12,16)(H,14,15)
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Similars

Article
PubMed
n/an/a<6.31E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Reuptake inhibitory activity against dopamine DA transporter


Bioorg Med Chem Lett 27: 2023-2028 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.078
BindingDB Entry DOI: 10.7270/Q23R0W54
More data for this
Ligand-Target Pair