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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Pteridine reductase 1' and Ligand = 'BDBM50404663'   
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
Pteridine reductase 1


(Leishmania major)
BDBM50404663
PNG
(CHEMBL6885 | QUINAZOLINE-2,4,6-TRIAMINE)
Show SMILES Nc1ccc2nc(N)nc(N)c2c1
Show InChI InChI=1S/C8H9N5/c9-4-1-2-6-5(3-4)7(10)13-8(11)12-6/h1-3H,9H2,(H4,10,11,12,13)
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Article
PubMed
n/an/an/a 5.88E+4n/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Binding affinity to Leishmania major pteridine reductase 1


Eur J Med Chem 92: 314-31 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.051
BindingDB Entry DOI: 10.7270/Q2542Q91
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)