Ki Summary

Reaction Details

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Target

Cholesteryl ester transfer protein

Ligand

BDBM50128183

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_636763 (CHEMBL1167052)

IC50

300±n/a nM

Citation

Abu Khalaf, R; Abu Sheikha, G; Bustanji, Y; Taha, MO Discovery of new cholesteryl ester transfer protein inhibitors via ligand-based pharmacophore modeling and QSAR analysis followed by synthetic exploration. Eur J Med Chem45:1598-617 (2010) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Cholesteryl ester transfer protein

Name:

Cholesteryl ester transfer protein

Synonyms:

CETP | CETP_RABIT

Type:

PROTEIN

Mol. Mass.:

54513.38

Organism:

Oryctolagus cuniculus

Description:

ChEMBL_1504757

Residue:

497

Sequence:

ACPKGASYEAGIVCRITKPALLVLNQETAKVVQTAFQRAGYPDVSGERAVMLLGRVKYGL
HNLQISHLSIASSQVELVDAKTIDVAIQNVSVVFKGTLNYSYTSAWGLGINQSVDFEIDS
AIDLQINTELTCDAGSVRTNAPDCYLAFHKLLLHLQGEREPGWLKQLFTNFISFTLKLIL
KRQVCNEINTISNIMADFVQTRAASILSDGDIGVDISVTGAPVITATYLESHHKGHFTHK
NVSEAFPLRAFPPGLLGDSRMLYFWFSDQVLNSLARAAFQEGRLVLSLTGDEFKKVLETQ
GFDTNQEIFQELSRGLPTGQAQVAVHCLKVPKISCQNRGVVVSSSVAVTFRFPRPDGREA
VAYRFEEDIITTVQASYSQKKLFLHLLDFQCVPASGRAGSSANLSVALRTEAKAVSNLTE
SRSESLQSSLRSLIATVGIPEVMSRLEVAFTALMNSKGLDLFEIINPEIITLDGCLLLQM
DFGFPKHLLVDFLQSLS

BDBM50128183

n/a

Name

BDBM50128183

Synonyms:

1,1,1-Trifluoro-3-{(3-isopropoxy-phenyl)-[3-(1,1,2,2-tetrafluoro-ethoxy)-benzyl]-amino}-propan-2-ol | 1,1,1-trifluoro-3-((3-isopropoxyphenyl)(3-(1,1,2,2-tetrafluoroethoxy)benzyl)amino)propan-2-ol | 3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-isopropoxyphenyl)amino)-1,1,1-trifluoropropan-2-ol | CHEMBL68726

Type

Small organic molecule

Emp. Form.

C21H22F7NO3

Mol. Mass.

469.3931

SMILES

CC(C)Oc1cccc(c1)N(CC(O)C(F)(F)F)Cc1cccc(OC(F)(F)C(F)F)c1

Structure