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Target
Cholesteryl ester transfer protein
Ligand
BDBM50169298
Substrate
n/a
Meas. Tech.
ChEMBL_306246 (CHEMBL831156)
IC50
700±n/a nM
Citation
 Brückner, D; Hafner, FT; Li, V; Schmeck, C; Telser, J; Vakalopoulos, A; Wirtz, G Dibenzodioxocinones--a new class of CETP inhibitors. Bioorg Med Chem Lett 15:3611-4 (2005) [PubMed]  Article 
Target
Name:
Cholesteryl ester transfer protein
Synonyms:
CETP | CETP_HUMAN | Cholesteryl ester transfer protein (CETP) | Lipid transfer protein I
Type:
Enzyme
Mol. Mass.:
54751.53
Organism:
Homo sapiens (Human)
Description:
P11597
Residue:
493
Sequence:
MLAATVLTLALLGNAHACSKGTSHEAGIVCRITKPALLVLNHETAKVIQTAFQRASYPDITGEKAMMLLGQVKYGLHNIQISHLSIASSQVELVEAKSIDVSIQNVSVVFKGTLKYGYTTAWWLGIDQSIDFEIDSAIDLQINTQLTCDSGRVRTDAPDCYLSFHKLLLHLQGEREPGWIKQLFTNFISFTLKLVLKGQICKEINVISNIMADFVQTRAASILSDGDIGVDISLTGDPVITASYLESHHKGHFIYKNVSEDLPLPTFSPTLLGDSRMLYFWFSERVFHSLAKVAFQDGRLMLSLMGDEFKAVLETWGFNTNQEIFQEVVGGFPSQAQVTVHCLKMPKISCQNKGVVVNSSVMVKFLFPRPDQQHSVAYTFEEDIVTTVQASYSKKKLFLSLLDFQITPKTVSNLTESSSESVQSFLQSMITAVGIPEVMSRLEVVFTALMNSKGVSLFDIINPEIITRDGFLLLQMDFGFPEHLLVDFLQSLS
  
Inhibitor
Name:
BDBM50169298
Synonyms:
CHEMBL425360 | Propane-2-sulfonic acid 2-((S)-1-hydroxy-3-methyl-butyl)-1-methoxy-8-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-6-yl ester
Type:
Small organic molecule
Emp. Form.:
C23H28O8S
Mol. Mass.:
464.529
SMILES:
COc1c(ccc2Oc3c(OS(=O)(=O)C(C)C)cc(C)cc3OC(=O)c12)[C@@H](O)CC(C)C
Structure:
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