Reaction Details Report a problem with these data
Target
Dihydroorotate dehydrogenase (quinone), mitochondrial [100-517]
Ligand
BDBM28808
Substrate
BDBM14700
Meas. Tech.
DHODH Inhibition Assay
IC50
>100000±n/a nM
Citation
Gujjar, R; Marwaha, A; El Mazouni, F; White, J; White, KL; Creason, S; Shackleford, DM; Baldwin, J; Charman, WN; Buckner, FS; Charman, S; Rathod, PK; Phillips, MA Identification of a metabolically stable triazolopyrimidine-based dihydroorotate dehydrogenase inhibitor with antimalarial activity in mice. J Med Chem 52:1864-72 (2009) [PubMed] Article
More Info.:
Target
Name:
Dihydroorotate dehydrogenase (quinone), mitochondrial [100-517]
Synonyms:
Dihydroorotate Dehydrogenase (DHODH) | Dihydroorotate dehydrogenase, mitochondrial, putative
Type:
Enzyme
Mol. Mass.:
47311.25
Organism:
Plasmodium berghei
Description:
A0A509AEH5[100-517]
Residue:
418
Sequence:
MKRFDERMNKEKSKHKKVLFFIFSSIVGLYMYFESYNPEFFMYDVFLDFCLNYVDSEVCHDLFLLLGKYGLLPYDTSNDSVYATSDIKNLNFINPFGVAAGFDKNGICIDSILKLGFSFIEIGTITPKPQKGNNKPRIFRDVENKSIINACGFNNIGCDKVTENLINFRKKQEEDKLLSKHIVGVSIGKNKHTENIVDDLKYSIYKIARYADYIAINVSSPNTPGLRDNQESNKLKNIILFVKQEINKIEQIGHNGETFWMNTIKKKPLVFVKLAPDLENSEKKKIAQVLLDTGIDGMIISNTTINKMDIKSFEDKKGGVSGKKLKDLSTNLISDMYIYTNKQIPIIASGGILTGADALEKIEAGASVCQLYSCLVFNGVKSAIQIKREFNNALYQKGYYNLREAIGKKHSNAKSLKV
Inhibitor
Name:
BDBM28808
Synonyms:
2-({5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)benzonitrile | triazolopyrimidine-based compound, DSM92
Type:
Small organic molecule
Emp. Form.:
C13H10N6
Mol. Mass.:
250.2587
SMILES:
Cc1cc(Nc2ccccc2C#N)n2ncnc2n1