Reaction Details Report a problem with these data
Target
Elongation of very long chain fatty acids protein 6
Ligand
BDBM50299946
Substrate
n/a
Meas. Tech.
ChEMBL_592845 (CHEMBL1045788)
IC50
31±n/a nM
Citation
Mizutani, T; Ishikawa, S; Nagase, T; Takahashi, H; Fujimura, T; Sasaki, T; Nagumo, A; Shimamura, K; Miyamoto, Y; Kitazawa, H; Kanesaka, M; Yoshimoto, R; Aragane, K; Tokita, S; Sato, N Discovery of novel benzoxazinones as potent and orally active long chain fatty acid elongase 6 inhibitors. J Med Chem 52:7289-300 (2009) [PubMed] Article
More Info.:
Target
Name:
Elongation of very long chain fatty acids protein 6
Synonyms:
ELOV6_MOUSE | Elovl6 | Face | Lce | Masr
Type:
PROTEIN
Mol. Mass.:
31624.93
Organism:
Mus musculus
Description:
ChEMBL_572244
Residue:
267
Sequence:
MNMSVLTLQEYEFEKQFNENEAIQWMQENWKKSFLFSALYAAFIFGGRHLMNKRAKFELRKPLVLWSLTLAVFSIFGALRTGAYMLYILMTKGLKQSVCDQSFYNGPVSKFWAYAFVLSKAPELGDTIFIILRKQKLIFLHWYHHITVLLYSWYSYKDMVAGGGWFMTMNYGVHAVMYSYYALRAAGFRVSRKFAMFITLSQITQMLMGCVINYLVFNWMQHDNDQCYSHFQNIFWSSLMYLSYLVLFCHFFFEAYIGKVKKATKAE
Inhibitor
Name:
BDBM50299946
Synonyms:
1-{[(-)-6-Chloro-2-oxo-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-4-yl]methyl}-3-(4-fluorophenyl)urea | 1-{[6-Chloro-2-oxo-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-4-yl]methyl}-3-(4-fluorophenyl)urea | CHEMBL570576
Type:
Small organic molecule
Emp. Form.:
C17H12ClF4N3O3
Mol. Mass.:
417.742
SMILES:
Fc1ccc(NC(=O)NCC2(OC(=O)Nc3ccc(Cl)cc23)C(F)(F)F)cc1