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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50286606'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50286606
PNG
((4aS,12bR)-11-Chloro-10-hydroxy-4,4,4a,12b-tetrame...)
Show SMILES CC1(C)CCC[C@]2(C)C3C=C4C(Cl)C(=O)C(=O)C=C4OC3CC[C@@]12C |c:17,t:9|
Show InChI InChI=1S/C21H27ClO3/c1-19(2)7-5-8-20(3)13-10-12-16(11-14(23)18(24)17(12)22)25-15(13)6-9-21(19,20)4/h10-11,13,15,17H,5-9H2,1-4H3/t13?,15?,17?,20-,21+/m1/s1
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Article
n/an/a 300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for Cholesteryl ester transfer protein (CETP) inhibition by CETP-SPA assay


Bioorg Med Chem Lett 5: 605-610 (1995)


Article DOI: 10.1016/0960-894X(95)00081-4
BindingDB Entry DOI: 10.7270/Q20R9PWJ
More data for this
Ligand-Target Pair