Target
Acyl-CoA (8-3)-desaturase
Ligand
BDBM50245999
Substrate
n/a
Meas. Tech.
ChEMBL_1676417 (CHEMBL4026560)
IC50
0.520000±n/a nM
Citation
 Fujimoto, JOkamoto, RNoguchi, NHara, RMasada, SKawamoto, TNagase, HTamura, YOImanishi, MTakagahara, SKubo, KTohyama, KIida, KAndou, TMiyahisa, IMatsui, JHayashi, RMaekawa, TMatsunaga, N Discovery of 3,5-Diphenyl-4-methyl-1,3-oxazolidin-2-ones as Novel, Potent, and Orally Available?-5 Desaturase (D5D) Inhibitors. J Med Chem 60:8963-8981 (2017) [PubMed]  Article 
Target
Name:
Acyl-CoA (8-3)-desaturase
Synonyms:
FADS1 | FADS1_HUMAN | FADSD5 | Fatty acid desaturase 1
Type:
PROTEIN
Mol. Mass.:
51985.80
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1513296
Residue:
444
Sequence:
MAPDPVAAETAAQGPTPRYFTWDEVAQRSGCEERWLVIDRKVYNISEFTRRHPGGSRVISHYAGQDATDPFVAFHINKGLVKKYMNSLLIGELSPEQPSFEPTKNKELTDEFRELRATVERMGLMKANHVFFLLYLLHILLLDGAAWLTLWVFGTSFLPFLLCAVLLSAVQAQAGWLQHDFGHLSVFSTSKWNHLLHHFVIGHLKGAPASWWNHMHFQHHAKPNCFRKDPDINMHPFFFALGKILSVELGKQKKKYMPYNHQHKYFFLIGPPALLPLYFQWYIFYFVIQRKKWVDLAWMITFYVRFFLTYVPLLGLKAFLGLFFIVRFLESNWFVWVTQMNHIPMHIDHDRNMDWVSTQLQATCNVHKSAFNDWFSGHLNFQIEHHLFPTMPRHNYHKVAPLVQSLCAKHGIEYQSKPLLSAFADIIHSLKESGQLWLDAYLHQ
  
Inhibitor
Name:
BDBM50245999
Synonyms:
CHEMBL4084502
Type:
Small organic molecule
Emp. Form.:
C17H12ClFN2O2
Mol. Mass.:
330.741
SMILES:
C[C@H]1[C@@H](OC(=O)N1c1cc(Cl)cc(c1)C#N)c1ccc(F)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: