Reaction Details Report a problem with these data
Target
Dihydroorotate dehydrogenase (quinone), mitochondrial
Ligand
BDBM155489
Substrate
n/a
Meas. Tech.
Enzyme Assay
pH
8±n/a
IC50
18±n/a nM
Comments
extracted
Citation
 Thunuguntla, SS; Subramanya, H; Kunnam, SR; Sanivaru Vijay, SR; Bingi, C; Kusanur, R; Schwarz, M; Arlt, M Dihydroorotate dehydrogenase inhibitors US Patent  US9006454 Publication Date 4/14/2015 
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:
BDBM155489
Synonyms:
US9006454, I131
Type:
Small organic molecule
Emp. Form.:
C20H9F5N2O2
Mol. Mass.:
404.2897
SMILES:
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1F |(-7.14,3.26,;-5.8,2.49,;-4.47,3.26,;-5.8,.95,;-7.14,.18,;-7.14,-1.36,;-5.8,-2.13,;-4.47,-1.36,;-3.01,-1.84,;-2.1,-.59,;-3.01,.65,;-4.47,.18,;-.56,-.59,;.21,.74,;-.56,2.08,;1.75,.74,;2.52,2.08,;2.52,-.59,;1.75,-1.92,;2.52,-3.26,;.21,-1.92,;-.56,-3.26,;4.06,-.59,;4.83,-1.93,;6.37,-1.93,;7.14,-.59,;6.37,.74,;4.83,.74,;4.06,2.08,)|
Structure:
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