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Target
Cholesteryl ester transfer protein
Ligand
BDBM50169216
Substrate
n/a
Meas. Tech.
ChEMBL_1577866 (CHEMBL3808209)
IC50
20±n/a nM
Citation
 Wilson, JE; Kurukulasuriya, R; Reibarkh, M; Reiter, M; Zwicker, A; Zhao, K; Zhang, F; Anand, R; Colandrea, VJ; Cumiskey, AM; Crespo, A; Duffy, RA; Murphy, BA; Mitra, K; Johns, DG; Duffy, JL; Vachal, P Discovery of Novel Indoline Cholesterol Ester Transfer Protein Inhibitors (CETP) through a Structure-Guided Approach. ACS Med Chem Lett 7:261-5 (2016) [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:
BDBM50169216
Synonyms:
CHEMBL3805336
Type:
Small organic molecule
Emp. Form.:
C27H23F9N2O
Mol. Mass.:
562.4699
SMILES:
C[C@@H](N1C[C@H](N(C[C@@H](O)C(F)(F)F)c2ccccc12)c1cccc(c1)C(F)(F)F)c1cccc(c1)C(F)(F)F |r|
Structure:
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