Reaction Details Report a problem with these data
Target
Liver carboxylesterase 1
Ligand
BDBM50034738
Substrate
n/a
Meas. Tech.
Fluorescent ACAT Assay
IC50
1.987e+4±n/a nM
Citation
 Li, X; Zou, Y; Zhao, Q; Yang, Y; Wu, M; Huang, T; Hu, H; Wu, Q Synthesis, biological evaluation, and molecular docking studies of xanthone sulfonamides as ACAT inhibitors. Chem Biol Drug Des 85:394-403 (2015) [PubMed]  Article 
Target
Name:
Liver carboxylesterase 1
Synonyms:
Acyl coenzyme A:cholesterol acyltransferase | Acyl-CoA: cholesterol acyltransferase (ACAT) | CES1 | CES2 | EST1_HUMAN | SES1 | Serine hydrolase (CES1)
Type:
Protein
Mol. Mass.:
62520.83
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
567
Sequence:
MWLRAFILATLSASAAWGHPSSPPVVDTVHGKVLGKFVSLEGFAQPVAIFLGIPFAKPPLGPLRFTPPQPAEPWSFVKNATSYPPMCTQDPKAGQLLSELFTNRKENIPLKLSEDCLYLNIYTPADLTKKNRLPVMVWIHGGGLMVGAASTYDGLALAAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIASFGGNPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTSVLVKKGDVKPLAEQIAITAGCKTTTSAVMVHCLRQKTEEELLETTLKMKFLSLDLQGDPRESQPLLGTVIDGMLLLKTPEELQAERNFHTVPYMVGINKQEFGWLIPMQLMSYPLSEGQLDQKTAMSLLWKSYPLVCIAKELIPEATEKYLGGTDDTVKKKDLFLDLIADVMFGVPSVIVARNHRDAGAPTYMYEFQYRPSFSSDMKPKTVIGDHGDELFSVFGAPFLKEGASEEEIRLSKMVMKFWANFARNGNPNGEGLPHWPEYNQKEGYLQIGANTQAAQKLKDKEVAFWTNLFAKKAVEKPPQTEHIEL
  
Inhibitor
Name:
BDBM50034738
Synonyms:
3-(Decyl-dimethyl-silanyl)-N-(1-phenyl-2-p-tolyl-ethyl)-propionamide | CHEMBL40998 | SA-58035 | Sandoz58-35
Type:
Small organic molecule
Emp. Form.:
C30H47NOSi
Mol. Mass.:
465.7858
SMILES:
CCCCCCCCCC[Si](C)(C)CCC(=O)NC(Cc1ccc(C)cc1)c1ccccc1
Structure:
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