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Target
Acyl-CoA (8-3)-desaturase
Ligand
BDBM50535222
Substrate
n/a
Meas. Tech.
ChEMBL_1929995 (CHEMBL4433171)
IC50
19±n/a nM
Citation
 Miyahisa, I; Suzuki, H; Mizukami, A; Tanaka, Y; Ono, M; Hixon, MS; Matsui, J T-3364366 Targets the Desaturase Domain of Delta-5 Desaturase with Nanomolar Potency and a Multihour Residence Time. ACS Med Chem Lett 7:868-72 (2016) [PubMed]  Article 
Target
Name:
Acyl-CoA (8-3)-desaturase
Synonyms:
FADS1_RAT | Fads1 | Fatty acid desaturase 1
Type:
PROTEIN
Mol. Mass.:
52505.96
Organism:
Rattus norvegicus
Description:
ChEMBL_852948
Residue:
447
Sequence:
MAPDPVQTPDPASAQLRQMRYFTWEEVAQRSGREKERWLVIDRKVYNISDFSRRHPGGSRVISHYAGQDATDPFVAFHINKGLVRKYMNSLLIGELAPEQPSFEPTKNKALTDEFRELRATVERMGLMKANHLFFLFYLLHILLLDVAAWLTLWIFGTSLVPFTLCAVLLSTVQAQAGWLQHDFGHLSVFSTSTWNHLVHHFVIGHLKGAPASWWNHMHFQHHAKPNCFRKDPDINMHPLFFALGKVLSVELGKEKKKHMPYNHQHKYFFLIGPPALLPLYFQWYIFYFVVQRKKWVDLAWMLSFYVRVFFTYMPLLGLKGLLCLFFIVRFLESNWFVWVTQMNHIPMHIDHDRNVDWVSTQLQATCNVHQSAFNNWFSGHLNFQIEHHLFPTMPRHNYHKVAPLVQSLCAKYGIKYESKPLLTAFADIVYSLKESGQLWLDAYLHQ
  
Inhibitor
Name:
BDBM50535222
Synonyms:
CHEMBL4439992
Type:
Small organic molecule
Emp. Form.:
C18H16F3N3O3S2
Mol. Mass.:
443.463
SMILES:
CC(=O)NCCSc1nc2cscc2c(=O)n1-c1ccc(OCC(F)(F)F)cc1
Structure:
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