Reaction Details  Report a problem with these data
Target
Dihydroorotate dehydrogenase (quinone), mitochondrial
Ligand
BDBM50281173
Substrate
n/a
Meas. Tech.
ChEMBL_1722384 (CHEMBL4137384)
IC50
>5000±n/a nM
Citation
 Sainas, S; Pippione, AC; Lupino, E; Giorgis, M; Circosta, P; Gaidano, V; Goyal, P; Bonanni, D; Rolando, B; Cignetti, A; Ducime, A; Andersson, M; Järvå, M; Friemann, R; Piccinini, M; Ramondetti, C; Buccinnà, B; Al-Karadaghi, S; Boschi, D; Saglio, G; Lolli, ML Targeting Myeloid Differentiation Using Potent 2-Hydroxypyrazolo[1,5- a]pyridine Scaffold-Based Human Dihydroorotate Dehydrogenase Inhibitors. J Med Chem 61:6034-6055 (2018) [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:
BDBM50281173
Synonyms:
CHEMBL4169359
Type:
Small organic molecule
Emp. Form.:
C21H13F4N3O2
Mol. Mass.:
415.3404
SMILES:
Cn1n2ccccc2c(C(=O)Nc2c(F)c(F)c(c(F)c2F)-c2ccccc2)c1=O
Structure:
Search PDB for entries with ligand similarity: