Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAcyl-CoA 6-desaturase
LigandBDBM50257808
Substrate/Competitorn/a
Meas. Tech.ChEMBL_562450 (CHEMBL1010953)
IC50>30±n/a nM
Citation Koltun, DOParkhill, EQVasilevich, NIGlushkov, AIZilbershtein, TMIvanov, AVCole, AGHenderson, IZautke, NABrunn, SAMollova, NLeung, KChisholm, JWZablocki, J Novel, potent, selective, and metabolically stable stearoyl-CoA desaturase (SCD) inhibitors. Bioorg Med Chem Lett19:2048-52 (2009) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acyl-CoA 6-desaturase
Name:Acyl-CoA 6-desaturase
Synonyms:FADS2_RAT | Fads2 | Fadsd6 | Fatty acid desaturase 2
Type:PROTEIN
Mol. Mass.:52399.93
Organism:Rattus norvegicus
Description:ChEMBL_852950
Residue:444
Sequence:
MGKGGNQGEGSTELQAPMPTFRWEEIQKHNLRTDRWLVIDRKVYNVTKWSQRHPGGHRVI
GHYSGEDATDAFRAFHLDLDFVGKFLKPLLIGELAPEEPSLDRGKSSQITEDFRALKKTA
EDMNLFKTNHLFFFLLLSHIIVMESIAWFILSYFGNGWIPTVITAFVLATSQAQAGWLQH
DYGHLSVYKKSIWNHIVHKFVIGHLKGASANWWNHRHFQHHAKPNIFHKDPDIKSLHVFV
LGEWQPLEYGKKKLKYLPYNHQHEYFFLIGPPLLIPMYFQYQIIMTMIRRRDWVDLAWAI
SYYARFFYTYIPFYGILGALVFLNFIRFLESHWFVWVTQMNHIVMEIDLDHYRDWFSSQL
AATCNVEQSFFNDWFSGHLNFQIEHHLFPTMPRHNLHKIAPLVKSLCAKHGIEYQEKPLL
RALLDIVSSLKKSGELWLDAYLHK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50257808
n/a
NameBDBM50257808
Synonyms:CHEMBL495001 | N-(2-(6-(3,4-dichlorobenzylamino)-3-oxo-2-(pyridin-3-yl)pyrido[2,3-b]pyrazin-4(3H)-yl)ethyl)acetamide
TypeSmall organic molecule
Emp. Form.C23H20Cl2N6O2
Mol. Mass.483.35
SMILESCC(=O)NCCn1c2nc(NCc3ccc(Cl)c(Cl)c3)ccc2nc(-c2cccnc2)c1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: