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Target
Dihydroorotate dehydrogenase (quinone), mitochondrial
Ligand
BDBM50313602
Substrate
n/a
Meas. Tech.
ChEMBL_614225 (CHEMBL1106928)
IC50
5500±n/a nM
Citation
 McLean, LR; Zhang, Y; Degnen, W; Peppard, J; Cabel, D; Zou, C; Tsay, JT; Subramaniam, A; Vaz, RJ; Li, Y Discovery of novel inhibitors for DHODH via virtual screening and X-ray crystallographic structures. Bioorg Med Chem Lett 20:1981-4 (2010) [PubMed]  Article 
Target
Name:
Dihydroorotate dehydrogenase (quinone), mitochondrial
Synonyms:
DHODH | DHOdehase | Dihydroorotate dehydrogenase | Dihydroorotate dehydrogenase (DHODH) | Dihydroorotate dehydrogenase, mitochondrial | Dihydroorotate oxidase | Dihydroorotate oxidase (DHODH) | PYRD_HUMAN
Type:
Enzyme
Mol. Mass.:
42881.33
Organism:
Homo sapiens (Human)
Description:
Q02127
Residue:
395
Sequence:
MAWRHLKKRAQDAVIILGGGGLLFASYLMATGDERFYAEHLMPTLQGLLDPESAHRLAVRFTSLGLLPRARFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPKPQEGNPRPRVFRLPEDQAVINRYGFNSHGLSVVEHRLRARQQKQAKLTEDGLPLGVNLGKNKTSVDAAEDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDGLRRVHRPAVLVKIAPDLTSQDKEDIASVVKELGIDGLIVTNTTVSRPAGLQGALRSETGGLSGKPLRDLSTQTIREMYALTQGRVPIIGVGGVSSGQDALEKIRAGASLVQLYTALTFWGPPVVGKVKRELEALLKEQGFGGVTDAIGADHRR
  
Inhibitor
Name:
BDBM50313602
Synonyms:
5-(methyl(pyridin-3-ylmethyl)amino)-2-propionamidobenzoic acid | 5-[methyl(pyridin-3-ylmethyl)amino]-2-(propanoylamino)benzoic acid | CHEMBL1084927
Type:
Small organic molecule
Emp. Form.:
C17H19N3O3
Mol. Mass.:
313.3511
SMILES:
CCC(=O)Nc1ccc(cc1C(O)=O)N(C)Cc1cccnc1
Structure:
Search PDB for entries with ligand similarity: