Target
Dihydroorotate dehydrogenase (quinone), mitochondrial
Ligand
BDBM16106
Substrate
BDBM16100
Meas. Tech.
DHODH Inhibition Assay
pH
8±n/a
Temperature
295.15±n/a K
Ki
>100000±n/a nM
Km
6600±700 nM
kcat
15.4±0.2 1/sec
Citation
 Hurt, DESutton, AEClardy, J Brequinar derivatives and species-specific drug design for dihydroorotate dehydrogenase. Bioorg Med Chem Lett 16:1610-5 (2006) [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:
BDBM16106
Synonyms:
3-carbamoyl-5-{4-[4-(trifluoromethyl)phenyl]phenyl}benzoic acid | 5-carbamoyl-4 -(trifluoromethyl)-1,1 :4 ,1 -terphenyl-3-carboxylic acid | AMX04 | Brequinar-derived asymmetric terphenyl compound
Type:
Small organic molecule
Emp. Form.:
C21H14F3NO3
Mol. Mass.:
385.336
SMILES:
NC(=O)c1cc(cc(c1)-c1ccc(cc1)-c1ccc(cc1)C(F)(F)F)C(O)=O
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM16100
Synonyms:
2,3-dimethoxy-5-methyl-6-(3-methyl-2-butenyl)-1,4-benzoquinone | 2,3-dimethoxy-5-methyl-6-(3-methylbut-2-en-1-yl)cyclohexa-2,5-diene-1,4-dione | Coenzyme Q1 | Ubiquinone 5
Type:
Small organic molecule
Emp. Form.:
C14H18O4
Mol. Mass.:
250.2903
SMILES:
[#6]-[#8]-[#6]-1=[#6](-[#8]-[#6])-[#6](=O)-[#6](-[#6]\[#6]=[#6](\[#6])-[#6])=[#6](-[#6])-[#6]-1=O |c:2,t:13|
Structure:
Search PDB for entries with ligand similarity: