Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCholesteryl ester transfer protein
LigandBDBM264521
Substrate/Competitorn/a
Meas. Tech.Radioactive Assays of CETP-Catalyzed CE and TG Transfer (RTA Assay)
IC50 3357±n/a nM
Citation Ondeyka, DQian, XVachal, PTyagarajan, SSmith, CJLi, HBao, J Spirocyclic CETP inhibitors US Patent US9717714 Publication Date 8/1/2017
More Info.:Get all data from this article,  Assay Method
 
Cholesteryl ester transfer protein
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:
MLAATVLTLALLGNAHACSKGTSHEAGIVCRITKPALLVLNHETAKVIQTAFQRASYPDI
TGEKAMMLLGQVKYGLHNIQISHLSIASSQVELVEAKSIDVSIQNVSVVFKGTLKYGYTT
AWWLGIDQSIDFEIDSAIDLQINTQLTCDSGRVRTDAPDCYLSFHKLLLHLQGEREPGWI
KQLFTNFISFTLKLVLKGQICKEINVISNIMADFVQTRAASILSDGDIGVDISLTGDPVI
TASYLESHHKGHFIYKNVSEDLPLPTFSPTLLGDSRMLYFWFSERVFHSLAKVAFQDGRL
MLSLMGDEFKAVLETWGFNTNQEIFQEVVGGFPSQAQVTVHCLKMPKISCQNKGVVVNSS
VMVKFLFPRPDQQHSVAYTFEEDIVTTVQASYSKKKLFLSLLDFQITPKTVSNLTESSSE
SVQSFLQSMITAVGIPEVMSRLEVVFTALMNSKGVSLFDIINPEIITRDGFLLLQMDFGF
PEHLLVDFLQSLS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM264521
n/a
NameBDBM264521
Synonyms:3-{3-[2-({(7R)-7-[3,5- bis(trifluoromethyl)phenyl]- 5-oxo-6-oxa-4- azaspiro[2.4]hept-4- yl}methyl)-6- (trifluoromethyl)pyridin-3- yl]-4- methoxyphenyl}propanoic acid | US9717714, 5
TypeSmall organic molecule
Emp. Form.C30H23F9N2O5
Mol. Mass.662.4996
SMILESCOc1ccc(CCC(O)=O)cc1-c1ccc(nc1CN1C(=O)O[C@H](c2cc(cc(c2)C(F)(F)F)C(F)(F)F)C11CC1)C(F)(F)F |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: