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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Enoyl-acyl carrier reductase' and Ligand = 'BDBM50435718'   
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
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435718
PNG
(CHEMBL2392449)
Show SMILES CCCc1cc(no1)-c1ccc(Oc2ccc(CNC(=O)c3cc(C)on3)cc2O)c(Cl)c1
Show InChI InChI=1S/C24H22ClN3O5/c1-3-4-17-12-19(27-33-17)16-6-8-22(18(25)11-16)31-23-7-5-15(10-21(23)29)13-26-24(30)20-9-14(2)32-28-20/h5-12,29H,3-4,13H2,1-2H3,(H,26,30)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 137n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Bioorg Med Chem Lett 23: 3551-5 (2013)


Article DOI: 10.1016/j.bmcl.2013.04.035
BindingDB Entry DOI: 10.7270/Q2XK8GZ7
More data for this
Ligand-Target Pair