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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 = 'BDBM184568'   
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))
BDBM184568
PNG
(US9150583, 5)
Show SMILES CC(C)c1nc2[C@H](O)C3(CC3)C[C@H](O)c2c2c1[C@H](OC21CCOCC1)c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C27H30F3NO4/c1-14(2)21-19-20(18-17(32)13-25(7-8-25)24(33)22(18)31-21)26(9-11-34-12-10-26)35-23(19)15-3-5-16(6-4-15)27(28,29)30/h3-6,14,17,23-24,32-33H,7-13H2,1-2H3/t17-,23+,24-/m0/s1
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Similars

US Patent
n/an/a 9n/an/an/an/an/a37



Boehringer Ingelheim International GmbH

US Patent


Assay Description
CETP inhibitory activity of compounds of the present invention can be determined in a fluorometric assay purchased from Roar Biomedical, Inc. (New Yo...


US Patent US9150583 (2015)


BindingDB Entry DOI: 10.7270/Q2Z89B5V
More data for this
Ligand-Target Pair