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TargetStearoyl-CoA desaturase
LigandBDBM50259133
Substrate/Competitorn/a
Meas. Tech.ChEMBL_499367 (CHEMBL1015819)
IC50 790±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 Lett19:3050-3 (2009) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Stearoyl-CoA desaturase
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:
MPAHLLQDDISSSYTTTTTITAPPSRVLQNGGDKLETMPLYLEDDIRPDIKDDIYDPTYK
DKEGPSPKVEYVWRNIILMSLLHLGALYGITLIPTCKFYTWLWGVFYYFVSALGITAGAH
RLWSHRSYKARLPLRLFLIIANTMAFQNDVYEWARDHRAHHKFSETHADPHNSRRGFFFS
HVGWLLVRKHPAVKEKGSTLDLSDLEAEKLVMFQRRYYKPGLLMMCFILPTLVPWYFWGE
TFQNSVFVATFLRYAVVLNATWLVNSAAHLFGYRPYDKNISPRENILVSLGAVGEGFHNY
HHSFPYDYSASEYRWHINFTTFFIDCMAALGLAYDRKKVSKAAILARIKRTGDGNYKSG
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50259133
n/a
NameBDBM50259133
Synonyms:CHEMBL466719 | benzyl 3-(3,4-dimethylbenzyl)-4-oxo-3,4-dihydroquinazolin-6-ylcarbamate
TypeSmall organic molecule
Emp. Form.C25H23N3O3
Mol. Mass.413.4684
SMILESCc1ccc(Cn2cnc3ccc(NC(=O)OCc4ccccc4)cc3c2=O)cc1C
Structure
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