Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAcyl-CoA desaturase 1
LigandBDBM50356906
Substrate/Competitorn/a
Meas. Tech.ChEMBL_785454 (CHEMBL1919933)
IC50 694±n/a nM
Citation Leclerc, JPFalgueyret, JPGirardin, MGuay, JGuiral, SHuang, ZLi, CSOballa, RRamtohul, YKSkorey, KTawa, PWang, HZhang, L Conversion of systemically-distributed triazole-based stearoyl-CoA desaturase (SCD) uHTS hits into liver-targeted SCD inhibitors. Bioorg Med Chem Lett21:6505-9 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acyl-CoA desaturase 1
Name:Acyl-CoA desaturase 1
Synonyms:ACOD1_RAT | Acyl-CoA desaturase 1 | Scd | Scd1 | Stearoyl-CoA desaturase 1 (SCD1)
Type:Enzyme
Mol. Mass.:41485.97
Organism:Rattus norvegicus (Rat)
Description:P07308
Residue:358
Sequence:
MPAHMLQEISSSYTTTTTITEPPSGNLQNGREKMKKVPLYLEEDIRPEMREDIHDPSYQD
EEGPPPKLEYVWRNIILMALLHVGALYGITLIPSSKVYTLLWGIFYYLISALGITAGAHR
LWSHRTYKARLPLRIFLIIANTMAFQNDVYEWARDHRAHHKFSETHADPHNSRRGFFFSH
VGWLLVRKHPAVKEKGGKLDMSDLKAEKLVMFQRRYYKPGLLLMCFILPTLVPWYCWGET
FLHSLFVSTFLRYTLVLNATWLVNSAAHLYGYRPYDKNIQSRENILVSLGAVGEGFHNYH
HAFPYDYSASEYRWHINFTTFFIDCMAALGLAYDRKKVSKAAVLARIKRTGDGSHKSS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50356906
n/a
NameBDBM50356906
Synonyms:CHEMBL1915555
TypeSmall organic molecule
Emp. Form.C17H11Br3N8O2
Mol. Mass.599.034
SMILESOC(=O)Cn1nnc(n1)-c1cncc(c1)-c1cn(Cc2cc(Br)c(Br)c(Br)c2)nn1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: