Reaction Details Report a problem with these data
Target
Elongation of very long chain fatty acids protein 6
Ligand
BDBM50299962
Substrate
n/a
Meas. Tech.
ChEMBL_592844 (CHEMBL1045787)
IC50
121±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 
Target
Name:
Elongation of very long chain fatty acids protein 6
Synonyms:
ELOV6_HUMAN | ELOVL6 | FACE | LCE
Type:
PROTEIN
Mol. Mass.:
31392.28
Organism:
Homo sapiens (Human)
Description:
ChEMBL_572238
Residue:
265
Sequence:
MNMSVLTLQEYEFEKQFNENEAIQWMQENWKKSFLFSALYAAFIFGGRHLMNKRAKFELRKPLVLWSLTLAVFSIFGALRTGAYMVYILMTKGLKQSVCDQGFYNGPVSKFWAYAFVLSKAPELGDTIFIILRKQKLIFLHWYHHITVLLYSWYSYKDMVAGGGWFMTMNYGVHAVMYSYYALRAAGFRVSRKFAMFITLSQITQMLMGCVVNYLVFCWMQHDQCHSHFQNIFWSSLMYLSYLVLFCHFFFEAYIGKMRKTTKAE
  
Inhibitor
Name:
BDBM50299962
Synonyms:
4-Fluoro-N-{[6-(isoxazol-4-yl)-2-oxo-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-4-yl]methyl}benzamide | CHEMBL584964
Type:
Small organic molecule
Emp. Form.:
C20H13F4N3O4
Mol. Mass.:
435.3285
SMILES:
Fc1ccc(cc1)C(=O)NCC1(OC(=O)Nc2ccc(cc12)-c1ccon1)C(F)(F)F
Structure:
Search PDB for entries with ligand similarity: