Target
Stearoyl-CoA desaturase
Ligand
BDBM50259089
Substrate
n/a
Meas. Tech.
ChEMBL_499367 (CHEMBL1015819)
IC50
250±n/a nM
Citation
 Koltun, DOVasilevich, NIParkhill, EQGlushkov, AIZilbershtein, TMMayboroda, EIBoze, MACole, AGHenderson, IZautke, NABrunn, SAChu, NHao, JMollova, NLeung, KChisholm, JWZablocki, J Orally bioavailable, liver-selective stearoyl-CoA desaturase (SCD) inhibitors. Bioorg Med Chem Lett 19:3050-3 (2009) [PubMed]  Article 
Target
Name:
Stearoyl-CoA desaturase
Synonyms:
Acyl-CoA desaturase | FADS5 | SCD | SCD1 | SCDOS | SCD_HUMAN | Stearoyl-CoA (SCD1) | Stearoyl-CoA desaturase 1
Type:
Enzyme
Mol. Mass.:
41537.27
Organism:
Homo sapiens (Human)
Description:
O00767
Residue:
359
Sequence:
MPAHLLQDDISSSYTTTTTITAPPSRVLQNGGDKLETMPLYLEDDIRPDIKDDIYDPTYKDKEGPSPKVEYVWRNIILMSLLHLGALYGITLIPTCKFYTWLWGVFYYFVSALGITAGAHRLWSHRSYKARLPLRLFLIIANTMAFQNDVYEWARDHRAHHKFSETHADPHNSRRGFFFSHVGWLLVRKHPAVKEKGSTLDLSDLEAEKLVMFQRRYYKPGLLMMCFILPTLVPWYFWGETFQNSVFVATFLRYAVVLNATWLVNSAAHLFGYRPYDKNISPRENILVSLGAVGEGFHNYHHSFPYDYSASEYRWHINFTTFFIDCMAALGLAYDRKKVSKAAILARIKRTGDGNYKSG
  
Inhibitor
Name:
BDBM50259089
Synonyms:
CHEMBL512775 | benzyl 3-(4-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-6-ylcarbamate
Type:
Small organic molecule
Emp. Form.:
C23H18ClN3O3
Mol. Mass.:
419.86
SMILES:
Clc1ccc(Cn2cnc3ccc(NC(=O)OCc4ccccc4)cc3c2=O)cc1
Structure:
Search PDB for entries with ligand similarity: