Reaction Details Report a problem with these data
Target
Acyl-CoA desaturase 1
Ligand
BDBM50443716
Substrate
n/a
Meas. Tech.
SCD1 Enzymatic Assay
Temperature
298.15±n/a K
IC50
8±n/a nM
Comments
extracted
Citation
 Yang, S; Kuo, G; Gaul, MD; Rano, TA Substituted piperidinyl-carboxamide derivatives useful as SCD 1 inhibitors US Patent  US9238658 Publication Date 1/19/2016 
Target
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:
MPAHMLQEISSSYTTTTTITEPPSGNLQNGREKMKKVPLYLEEDIRPEMREDIHDPSYQDEEGPPPKLEYVWRNIILMALLHVGALYGITLIPSSKVYTLLWGIFYYLISALGITAGAHRLWSHRTYKARLPLRIFLIIANTMAFQNDVYEWARDHRAHHKFSETHADPHNSRRGFFFSHVGWLLVRKHPAVKEKGGKLDMSDLKAEKLVMFQRRYYKPGLLLMCFILPTLVPWYCWGETFLHSLFVSTFLRYTLVLNATWLVNSAAHLYGYRPYDKNIQSRENILVSLGAVGEGFHNYHHAFPYDYSASEYRWHINFTTFFIDCMAALGLAYDRKKVSKAAVLARIKRTGDGSHKSS
  
Inhibitor
Name:
BDBM50443716
Synonyms:
CHEMBL3093874 | US9238658, 50
Type:
Small organic molecule
Emp. Form.:
C19H23FN4O2S
Mol. Mass.:
390.475
SMILES:
OCCc1cnc(NC(=O)N2CCC(CC2)N2CCc3ccc(F)cc23)s1
Structure:
Search PDB for entries with ligand similarity: