Target
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic
Ligand
BDBM50488589
Substrate
n/a
Meas. Tech.
ChEMBL_925787 (CHEMBL3072080)
IC50
49000±n/a nM
Citation
 Witschel, MRöhl, FNiggeweg, RNewton, T In search of new herbicidal inhibitors of the non-mevalonate pathway. Pest Manag Sci 69:559-63 (2013) [PubMed]  Article 
Target
Name:
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic
Synonyms:
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic | 1-deoxyxylulose-5-phosphate synthase | 2.2.1.7 | CLA1 | DEF | DEF | DXP synthase | DXPS | DXS | DXS_ARATH | Protein CLOROPLASTOS ALTERADOS 1
Type:
PROTEIN
Mol. Mass.:
76841.05
Organism:
Arabidopsis thaliana
Description:
ChEMBL_105557
Residue:
717
Sequence:
MASSAFAFPSYIITKGGLSTDSCKSTSLSSSRSLVTDLPSPCLKPNNNSHSNRRAKVCASLAEKGEYYSNRPPTPLLDTINYPIHMKNLSVKELKQLSDELRSDVIFNVSKTGGHLGSSLGVVELTVALHYIFNTPQDKILWDVGHQSYPHKILTGRRGKMPTMRQTNGLSGFTKRGESEHDCFGTGHSSTTISAGLGMAVGRDLKGKNNNVVAVIGDGAMTAGQAYEAMNNAGYLDSDMIVILNDNKQVSLPTATLDGPSPPVGALSSALSRLQSNPALRELREVAKGMTKQIGGPMHQLAAKVDEYARGMISGTGSSLFEELGLYYIGPVDGHNIDDLVAILKEVKSTRTTGPVLIHVVTEKGRGYPYAERADDKYHGVVKFDPATGRQFKTTNKTQSYTTYFAEALVAEAEVDKDVVAIHAAMGGGTGLNLFQRRFPTRCFDVGIAEQHAVTFAAGLACEGLKPFCAIYSSFMQRAYDQVVHDVDLQKLPVRFAMDRAGLVGADGPTHCGAFDVTFMACLPNMIVMAPSDEADLFNMVATAVAIDDRPSCFRYPRGNGIGVALPPGNKGVPIEIGKGRILKEGERVALLGYGSAVQSCLGAAVMLEERGLNVTVADARFCKPLDRALIRSLAKSHEVLITVEEGSIGGFGSHVVQFLALDGLLDGKLKWRPMVLPDRYIDHGAPADQLAEAGLMPSHIAATALNLIGAPREALF
  
Inhibitor
Name:
BDBM50488589
Synonyms:
CHEMBL2289496
Type:
Small organic molecule
Emp. Form.:
C22H20N4O2
Mol. Mass.:
372.4198
SMILES:
COc1ccc(\C=N\Nc2nc3ccccc3[nH]2)cc1OCc1ccccc1
Structure:
Search PDB for entries with ligand similarity: