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TargetDihydroorotate dehydrogenase (quinone), mitochondrial
LigandBDBM14702
Substrate/CompetitorBDBM14700
Meas. Tech.DHODH Inhibition Assay
Ki 15100±n/a nM
IC50 123300±n/a nM
Citation Heikkila, TRamsey, CDavies, MGaltier, CStead, AMJohnson, APFishwick, CWBoa, ANMcConkey, GA Design and synthesis of potent inhibitors of the malaria parasite dihydroorotate dehydrogenase. J Med Chem50:186-91 (2007) [PubMed]  Article
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Dihydroorotate dehydrogenase (quinone), mitochondrial
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:
MAWRHLKKRAQDAVIILGGGGLLFASYLMATGDERFYAEHLMPTLQGLLDPESAHRLAVR
FTSLGLLPRARFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSV
TPKPQEGNPRPRVFRLPEDQAVINRYGFNSHGLSVVEHRLRARQQKQAKLTEDGLPLGVN
LGKNKTSVDAAEDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQER
DGLRRVHRPAVLVKIAPDLTSQDKEDIASVVKELGIDGLIVTNTTVSRPAGLQGALRSET
GGLSGKPLRDLSTQTIREMYALTQGRVPIIGVGGVSSGQDALEKIRAGASLVQLYTALTF
WGPPVVGKVKRELEALLKEQGFGGVTDAIGADHRR
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  Blast E-value cutoff:
BDBM14702
BDBM14700
NameBDBM14702
Synonyms:1,3-diethyl 2-[(1H-indazol-5-ylamino)methylidene]propanedioate | 2-[(1H-Indazol-5-ylamino)-methylene]-malonic acid diethyl ester | bicyclic compound 7
TypeSmall organic molecule
Emp. Form.C15H17N3O4
Mol. Mass.303.3132
SMILESCCOC(=O)C(C=Nc1ccc2n[nH]cc2c1)C(=O)OCC |w:7.7|
Structure
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