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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 = 'BDBM254067'   
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))
BDBM254067
PNG
(US9493430, 758)
Show SMILES C[C@H]1[C@H](OC(=O)N1CC1=C(CCC(C)(C)C1)c1cc(ccc1F)-c1ccc(cc1C(F)(F)F)C(=O)N1CCOCC1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F |r,t:9|
Show InChI InChI=1S/C39H36F10N2O4/c1-21-33(24-14-26(37(41,42)43)18-27(15-24)38(44,45)46)55-35(53)51(21)20-25-19-36(2,3)9-8-28(25)30-16-22(5-7-32(30)40)29-6-4-23(17-31(29)39(47,48)49)34(52)50-10-12-54-13-11-50/h4-7,14-18,21,33H,8-13,19-20H2,1-3H3/t21-,33-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 7.10n/an/an/an/an/an/a



Chong Kun Dang Pharmaceutical Corp.

US Patent


Assay Description
As a protein source for cholesteryl ester transfer, plasma from healthy persons was used, and as a cholesteryl ester receptor, LDL from healthy perso...


US Patent US9493430 (2016)


BindingDB Entry DOI: 10.7270/Q2W37V7V
More data for this
Ligand-Target Pair