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PubMed code 22650305

Compile data set for download or QSAR
Found 64 hits of Enzyme Inhibition Constant Data   
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))
BDBM50392512
PNG
(CHEMBL2152165)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H25ClF5N3O2/c28-19-10-11-23(34-16-19)26(15-17-6-2-1-3-7-17,36-25(37)35-21-8-4-5-9-21)18-12-20(29)14-22(13-18)38-27(32,33)24(30)31/h1-3,6-7,10-14,16,21,24H,4-5,8-9,15H2,(H2,35,36,37)/t26-/m0/s1
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n/an/a 6.90n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394941
PNG
(CHEMBL2165719)
Show SMILES COc1ccc(cn1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1cc(F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C27H27F4N3O2/c1-36-24-12-11-19(17-32-24)26(16-18-7-3-2-4-8-18,34-25(35)33-23-9-5-6-10-23)20-13-21(27(29,30)31)15-22(28)14-20/h2-4,7-8,11-15,17,23H,5-6,9-10,16H2,1H3,(H2,33,34,35)/t26-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394932
PNG
(CHEMBL2165691)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1F)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H23ClF5N3O/c27-19-9-10-23(33-15-19)25(14-16-5-1-4-8-22(16)29,35-24(36)34-21-6-2-3-7-21)17-11-18(26(30,31)32)13-20(28)12-17/h1,4-5,8-13,15,21H,2-3,6-7,14H2,(H2,34,35,36)/t25-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392499
PNG
(CHEMBL2152152)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394933
PNG
(CHEMBL2165690)
Show SMILES Cc1ccc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C27H26ClF4N3O/c1-17-6-8-18(9-7-17)15-26(24-11-10-21(28)16-33-24,35-25(36)34-23-4-2-3-5-23)19-12-20(27(30,31)32)14-22(29)13-19/h6-14,16,23H,2-5,15H2,1H3,(H2,34,35,36)/t26-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394939
PNG
(CHEMBL2165681)
Show SMILES FC(F)C(F)(F)Oc1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H26ClF4N3O2/c28-20-13-14-23(33-17-20)26(16-18-7-2-1-3-8-18,35-25(36)34-21-10-4-5-11-21)19-9-6-12-22(15-19)37-27(31,32)24(29)30/h1-3,6-9,12-15,17,21,24H,4-5,10-11,16H2,(H2,34,35,36)
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n/an/a 25n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394943
PNG
(CHEMBL2165717)
Show SMILES Fc1ccc(nc1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1cc(F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C26H24F5N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 26n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392499
PNG
(CHEMBL2152152)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 31n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394942
PNG
(CHEMBL2165718)
Show SMILES Fc1cc(cc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)nc1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-23-11-10-18(16-32-23)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)19-12-20(26(29,30)31)14-21(28)13-19/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)
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n/an/a 31n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394940
PNG
(CHEMBL2165680)
Show SMILES FC(F)(F)Oc1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3N3O2/c27-20-13-14-23(31-17-20)25(16-18-7-2-1-3-8-18,33-24(34)32-21-10-4-5-11-21)19-9-6-12-22(15-19)35-26(28,29)30/h1-3,6-9,12-15,17,21H,4-5,10-11,16H2,(H2,32,33,34)
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n/an/a 31n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394931
PNG
(CHEMBL2165720)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@](Cc1ccccc1)(NC(=O)c1ccc(F)c(c1)C(F)(F)F)c1ccc(Cl)cn1
Show InChI InChI=1S/C29H18ClF9N2O2/c30-19-7-9-24(40-15-19)27(14-16-4-2-1-3-5-16,18-11-20(31)13-21(12-18)43-29(38,39)26(33)34)41-25(42)17-6-8-23(32)22(10-17)28(35,36)37/h1-13,15,26H,14H2,(H,41,42)/t27-/m0/s1
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Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394944
PNG
(CHEMBL2165707)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(cn1)C#N)C(F)(F)F
Show InChI InChI=1S/C27H24F4N4O/c28-22-13-20(12-21(14-22)27(29,30)31)26(15-18-6-2-1-3-7-18,24-11-10-19(16-32)17-33-24)35-25(36)34-23-8-4-5-9-23/h1-3,6-7,10-14,17,23H,4-5,8-9,15H2,(H2,34,35,36)/t26-/m0/s1
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n/an/a 36n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394934
PNG
(CHEMBL2165689)
Show SMILES Fc1cc(cc(c1)[C@](CC=C)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C22H22ClF4N3O/c1-2-9-21(19-8-7-16(23)13-28-19,30-20(31)29-18-5-3-4-6-18)14-10-15(22(25,26)27)12-17(24)11-14/h2,7-8,10-13,18H,1,3-6,9H2,(H2,29,30,31)/t21-/m0/s1
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n/an/a 85n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394935
PNG
(CHEMBL2165688)
Show SMILES Fc1ccc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C26H23ClF5N3O/c27-19-7-10-23(33-15-19)25(14-16-5-8-20(28)9-6-16,35-24(36)34-22-3-1-2-4-22)17-11-18(26(30,31)32)13-21(29)12-17/h5-13,15,22H,1-4,14H2,(H2,34,35,36)/t25-/m0/s1
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n/an/a 87n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50312718
PNG
(CHEMBL479527 | torcetrapib)
Show SMILES CCOC(=O)N1[C@H](CC)C[C@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)OC)c2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C26H25F9N2O4/c1-4-18-12-21(19-11-15(24(27,28)29)6-7-20(19)37(18)23(39)41-5-2)36(22(38)40-3)13-14-8-16(25(30,31)32)10-17(9-14)26(33,34)35/h6-11,18,21H,4-5,12-13H2,1-3H3/t18-,21+/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394946
PNG
(CHEMBL2165704)
Show SMILES Fc1ccc(nc1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C26H25F4N3O/c27-21-13-14-23(31-17-21)25(16-18-7-2-1-3-8-18,33-24(34)32-22-11-4-5-12-22)19-9-6-10-20(15-19)26(28,29)30/h1-3,6-10,13-15,17,22H,4-5,11-12,16H2,(H2,32,33,34)
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n/an/a 240n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394945
PNG
(CHEMBL2165705)
Show SMILES FC(F)(F)c1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3N3O/c27-21-13-14-23(31-17-21)25(16-18-7-2-1-3-8-18,33-24(34)32-22-11-4-5-12-22)19-9-6-10-20(15-19)26(28,29)30/h1-3,6-10,13-15,17,22H,4-5,11-12,16H2,(H2,32,33,34)
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Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394938
PNG
(CHEMBL2165682)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H25ClF5N3O2/c28-19-10-11-23(34-16-19)26(15-17-6-2-1-3-7-17,36-25(37)35-21-8-4-5-9-21)18-12-20(29)14-22(13-18)38-27(32,33)24(30)31/h1-3,6-7,10-14,16,21,24H,4-5,8-9,15H2,(H2,35,36,37)/t26-/m1/s1
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n/an/a 430n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392512
PNG
(CHEMBL2152165)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H25ClF5N3O2/c28-19-10-11-23(34-16-19)26(15-17-6-2-1-3-7-17,36-25(37)35-21-8-4-5-9-21)18-12-20(29)14-22(13-18)38-27(32,33)24(30)31/h1-3,6-7,10-14,16,21,24H,4-5,8-9,15H2,(H2,35,36,37)/t26-/m0/s1
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n/an/a 630n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394947
PNG
(CHEMBL2165703)
Show SMILES FC(F)(F)c1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccccn1
Show InChI InChI=1S/C26H26F3N3O/c27-26(28,29)21-12-8-11-20(17-21)25(23-15-6-7-16-30-23,18-19-9-2-1-3-10-19)32-24(33)31-22-13-4-5-14-22/h1-3,6-12,15-17,22H,4-5,13-14,18H2,(H2,31,32,33)
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n/an/a 700n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394939
PNG
(CHEMBL2165681)
Show SMILES FC(F)C(F)(F)Oc1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H26ClF4N3O2/c28-20-13-14-23(33-17-20)26(16-18-7-2-1-3-8-18,35-25(36)34-21-10-4-5-11-21)19-9-6-12-22(15-19)37-27(31,32)24(29)30/h1-3,6-9,12-15,17,21,24H,4-5,10-11,16H2,(H2,34,35,36)
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n/an/a 840n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394936
PNG
(CHEMBL2165687)
Show SMILES Cc1nc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)no1
Show InChI InChI=1S/C23H22ClF4N5O2/c1-13-30-20(33-35-13)11-22(19-7-6-16(24)12-29-19,32-21(34)31-18-4-2-3-5-18)14-8-15(23(26,27)28)10-17(25)9-14/h6-10,12,18H,2-5,11H2,1H3,(H2,31,32,34)/t22-/m0/s1
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n/an/a 1.07E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394937
PNG
(CHEMBL2165686)
Show SMILES Cc1csc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)n1
Show InChI InChI=1S/C24H23ClF4N4OS/c1-14-13-35-21(31-14)11-23(20-7-6-17(25)12-30-20,33-22(34)32-19-4-2-3-5-19)15-8-16(24(27,28)29)10-18(26)9-15/h6-10,12-13,19H,2-5,11H2,1H3,(H2,32,33,34)/t23-/m0/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394950
PNG
(CHEMBL2165696)
Show SMILES CC(C)(C)CC(=O)OC(Cc1ccccc1)(c1cccc(OC(F)(F)C(F)F)c1)c1ccccn1
Show InChI InChI=1S/C27H27F4NO3/c1-25(2,3)18-23(33)35-26(22-14-7-8-15-32-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)34-27(30,31)24(28)29/h4-16,24H,17-18H2,1-3H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392500
PNG
(CHEMBL2152153)
Show SMILES Fc1cc(cc(c1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394951
PNG
(CHEMBL2165695)
Show SMILES CC(C)(C)CC(=O)OC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3NO2/c1-24(2,3)16-23(32)33-25(15-18-8-5-4-6-9-18,22-13-12-21(27)17-31-22)19-10-7-11-20(14-19)26(28,29)30/h4-14,17H,15-16H2,1-3H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394954
PNG
(CHEMBL2165685)
Show SMILES COC(=O)C[C@](NC(=O)NC1CCCC1)(c1cc(F)cc(c1)C(F)(F)F)c1ccc(Cl)cn1
Show InChI InChI=1S/C22H22ClF4N3O3/c1-33-19(31)11-21(18-7-6-15(23)12-28-18,30-20(32)29-17-4-2-3-5-17)13-8-14(22(25,26)27)10-16(24)9-13/h6-10,12,17H,2-5,11H2,1H3,(H2,29,30,32)/t21-/m0/s1
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n/an/a 2.40E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394940
PNG
(CHEMBL2165680)
Show SMILES FC(F)(F)Oc1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3N3O2/c27-20-13-14-23(31-17-20)25(16-18-7-2-1-3-8-18,33-24(34)32-21-10-4-5-11-21)19-9-6-12-22(15-19)35-26(28,29)30/h1-3,6-9,12-15,17,21H,4-5,10-11,16H2,(H2,32,33,34)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394931
PNG
(CHEMBL2165720)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@](Cc1ccccc1)(NC(=O)c1ccc(F)c(c1)C(F)(F)F)c1ccc(Cl)cn1
Show InChI InChI=1S/C29H18ClF9N2O2/c30-19-7-9-24(40-15-19)27(14-16-4-2-1-3-5-16,18-11-20(31)13-21(12-18)43-29(38,39)26(33)34)41-25(42)17-6-8-23(32)22(10-17)28(35,36)37/h1-13,15,26H,14H2,(H,41,42)/t27-/m0/s1
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n/an/a 2.80E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392499
PNG
(CHEMBL2152152)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 2.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394948
PNG
(CHEMBL2165702)
Show SMILES Fc1ccc(cc1C(F)(F)F)C(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C28H19F7N2O/c29-23-13-12-19(15-22(23)28(33,34)35)25(38)37-26(24-11-4-5-14-36-24,17-18-7-2-1-3-8-18)20-9-6-10-21(16-20)27(30,31)32/h1-16H,17H2,(H,37,38)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394941
PNG
(CHEMBL2165719)
Show SMILES COc1ccc(cn1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1cc(F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C27H27F4N3O2/c1-36-24-12-11-19(17-32-24)26(16-18-7-3-2-4-8-18,34-25(35)33-23-9-5-6-10-23)20-13-21(27(29,30)31)15-22(28)14-20/h2-4,7-8,11-15,17,23H,5-6,9-10,16H2,1H3,(H2,33,34,35)/t26-/m1/s1
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n/an/a 3.40E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394933
PNG
(CHEMBL2165690)
Show SMILES Cc1ccc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C27H26ClF4N3O/c1-17-6-8-18(9-7-17)15-26(24-11-10-21(28)16-33-24,35-25(36)34-23-4-2-3-5-23)19-12-20(27(30,31)32)14-22(29)13-19/h6-14,16,23H,2-5,15H2,1H3,(H2,34,35,36)/t26-/m0/s1
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n/an/a 3.40E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394949
PNG
(CHEMBL2165701)
Show SMILES CC(C)(C)NC(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C25H26F3N3O/c1-23(2,3)30-22(32)31-24(21-14-7-8-15-29-21,17-18-10-5-4-6-11-18)19-12-9-13-20(16-19)25(26,27)28/h4-16H,17H2,1-3H3,(H2,30,31,32)
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n/an/a 3.80E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392499
PNG
(CHEMBL2152152)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 5.50E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394932
PNG
(CHEMBL2165691)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1F)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H23ClF5N3O/c27-19-9-10-23(33-15-19)25(14-16-5-1-4-8-22(16)29,35-24(36)34-21-6-2-3-7-21)17-11-18(26(30,31)32)13-20(28)12-17/h1,4-5,8-13,15,21H,2-3,6-7,14H2,(H2,34,35,36)/t25-/m0/s1
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n/an/a 6.40E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394953
PNG
(CHEMBL2165693)
Show SMILES CC(C)(C)CC(=O)O[C@@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m0/s1
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n/an/a 6.70E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394946
PNG
(CHEMBL2165704)
Show SMILES Fc1ccc(nc1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C26H25F4N3O/c27-21-13-14-23(31-17-21)25(16-18-7-2-1-3-8-18,33-24(34)32-22-11-4-5-12-22)19-9-6-10-20(15-19)26(28,29)30/h1-3,6-10,13-15,17,22H,4-5,11-12,16H2,(H2,32,33,34)
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n/an/a 6.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394952
PNG
(CHEMBL2165694)
Show SMILES CC(C)(C)CC(=O)O[C@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m1/s1
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n/an/a 6.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394934
PNG
(CHEMBL2165689)
Show SMILES Fc1cc(cc(c1)[C@](CC=C)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C22H22ClF4N3O/c1-2-9-21(19-8-7-16(23)13-28-19,30-20(31)29-18-5-3-4-6-18)14-10-15(22(25,26)27)12-17(24)11-14/h2,7-8,10-13,18H,1,3-6,9H2,(H2,29,30,31)/t21-/m0/s1
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n/an/a 7.10E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394943
PNG
(CHEMBL2165717)
Show SMILES Fc1ccc(nc1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1cc(F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C26H24F5N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m0/s1
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n/an/a 7.60E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394957
PNG
(CHEMBL2165700)
Show SMILES Fc1ccc(cc1)C(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C27H20F4N2O/c28-23-14-12-20(13-15-23)25(34)33-26(24-11-4-5-16-32-24,18-19-7-2-1-3-8-19)21-9-6-10-22(17-21)27(29,30)31/h1-17H,18H2,(H,33,34)
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n/an/a 8.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394951
PNG
(CHEMBL2165695)
Show SMILES CC(C)(C)CC(=O)OC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3NO2/c1-24(2,3)16-23(32)33-25(15-18-8-5-4-6-9-18,22-13-12-21(27)17-31-22)19-10-7-11-20(14-19)26(28,29)30/h4-14,17H,15-16H2,1-3H3
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n/an/a 9.40E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394935
PNG
(CHEMBL2165688)
Show SMILES Fc1ccc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C26H23ClF5N3O/c27-19-7-10-23(33-15-19)25(14-16-5-8-20(28)9-6-16,35-24(36)34-22-3-1-2-4-22)17-11-18(26(30,31)32)13-21(29)12-17/h5-13,15,22H,1-4,14H2,(H2,34,35,36)/t25-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394942
PNG
(CHEMBL2165718)
Show SMILES Fc1cc(cc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)nc1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-23-11-10-18(16-32-23)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)19-12-20(26(29,30)31)14-21(28)13-19/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394958
PNG
(CHEMBL2165699)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C28H20F6N2O/c29-27(30,31)22-12-6-10-20(16-22)25(37)36-26(24-14-4-5-15-35-24,18-19-8-2-1-3-9-19)21-11-7-13-23(17-21)28(32,33)34/h1-17H,18H2,(H,36,37)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394944
PNG
(CHEMBL2165707)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(cn1)C#N)C(F)(F)F
Show InChI InChI=1S/C27H24F4N4O/c28-22-13-20(12-21(14-22)27(29,30)31)26(15-18-6-2-1-3-7-18,24-11-10-19(16-32)17-33-24)35-25(36)34-23-8-4-5-9-23/h1-3,6-7,10-14,17,23H,4-5,8-9,15H2,(H2,34,35,36)/t26-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394948
PNG
(CHEMBL2165702)
Show SMILES Fc1ccc(cc1C(F)(F)F)C(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C28H19F7N2O/c29-23-13-12-19(15-22(23)28(33,34)35)25(38)37-26(24-11-4-5-14-36-24,17-18-7-2-1-3-8-18)20-9-6-10-21(16-20)27(30,31)32/h1-16H,17H2,(H,37,38)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394945
PNG
(CHEMBL2165705)
Show SMILES FC(F)(F)c1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C26H25ClF3N3O/c27-21-13-14-23(31-17-21)25(16-18-7-2-1-3-8-18,33-24(34)32-22-11-4-5-12-22)19-9-6-10-20(15-19)26(28,29)30/h1-3,6-10,13-15,17,22H,4-5,11-12,16H2,(H2,32,33,34)
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n/an/a 1.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394937
PNG
(CHEMBL2165686)
Show SMILES Cc1csc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)n1
Show InChI InChI=1S/C24H23ClF4N4OS/c1-14-13-35-21(31-14)11-23(20-7-6-17(25)12-30-20,33-22(34)32-19-4-2-3-5-19)15-8-16(24(27,28)29)10-18(26)9-15/h6-10,12-13,19H,2-5,11H2,1H3,(H2,32,33,34)/t23-/m0/s1
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n/an/a 2.40E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394947
PNG
(CHEMBL2165703)
Show SMILES FC(F)(F)c1cccc(c1)C(Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccccn1
Show InChI InChI=1S/C26H26F3N3O/c27-26(28,29)21-12-8-11-20(17-21)25(23-15-6-7-16-30-23,18-19-9-2-1-3-10-19)32-24(33)31-22-13-4-5-14-22/h1-3,6-12,15-17,22H,4-5,13-14,18H2,(H2,31,32,33)
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n/an/a 2.50E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394953
PNG
(CHEMBL2165693)
Show SMILES CC(C)(C)CC(=O)O[C@@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m0/s1
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n/an/a 2.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394959
PNG
(CHEMBL2165698)
Show SMILES CC(C)(C)CC(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H27F3N2O/c1-24(2,3)18-23(32)31-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3,(H,31,32)
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n/an/a 2.70E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394955
PNG
(CHEMBL2165684)
Show SMILES Fc1cc(cc(c1)[C@](Cc1ccccn1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C25H23ClF4N4O/c26-18-8-9-22(32-15-18)24(14-21-7-3-4-10-31-21,34-23(35)33-20-5-1-2-6-20)16-11-17(25(28,29)30)13-19(27)12-16/h3-4,7-13,15,20H,1-2,5-6,14H2,(H2,33,34,35)/t24-/m0/s1
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n/an/a 2.70E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394950
PNG
(CHEMBL2165696)
Show SMILES CC(C)(C)CC(=O)OC(Cc1ccccc1)(c1cccc(OC(F)(F)C(F)F)c1)c1ccccn1
Show InChI InChI=1S/C27H27F4NO3/c1-25(2,3)18-23(33)35-26(22-14-7-8-15-32-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)34-27(30,31)24(28)29/h4-16,24H,17-18H2,1-3H3
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n/an/a 2.80E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394936
PNG
(CHEMBL2165687)
Show SMILES Cc1nc(C[C@](NC(=O)NC2CCCC2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)no1
Show InChI InChI=1S/C23H22ClF4N5O2/c1-13-30-20(33-35-13)11-22(19-7-6-16(24)12-29-19,32-21(34)31-18-4-2-3-5-18)14-8-15(23(26,27)28)10-17(25)9-14/h6-10,12,18H,2-5,11H2,1H3,(H2,31,32,34)/t22-/m0/s1
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n/an/a 3.40E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394938
PNG
(CHEMBL2165682)
Show SMILES FC(F)C(F)(F)Oc1cc(F)cc(c1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C27H25ClF5N3O2/c28-19-10-11-23(34-16-19)26(15-17-6-2-1-3-7-17,36-25(37)35-21-8-4-5-9-21)18-12-20(29)14-22(13-18)38-27(32,33)24(30)31/h1-3,6-7,10-14,16,21,24H,4-5,8-9,15H2,(H2,35,36,37)/t26-/m1/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394952
PNG
(CHEMBL2165694)
Show SMILES CC(C)(C)CC(=O)O[C@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m1/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394952
PNG
(CHEMBL2165694)
Show SMILES CC(C)(C)CC(=O)O[C@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m1/s1
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n/an/a 5.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50392500
PNG
(CHEMBL2152153)
Show SMILES Fc1cc(cc(c1)[C@@](Cc1ccccc1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C26H24ClF4N3O/c27-20-10-11-23(32-16-20)25(15-17-6-2-1-3-7-17,34-24(35)33-22-8-4-5-9-22)18-12-19(26(29,30)31)14-21(28)13-18/h1-3,6-7,10-14,16,22H,4-5,8-9,15H2,(H2,33,34,35)/t25-/m1/s1
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n/an/a 7.20E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394949
PNG
(CHEMBL2165701)
Show SMILES CC(C)(C)NC(=O)NC(Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C25H26F3N3O/c1-23(2,3)30-22(32)31-24(21-14-7-8-15-29-21,17-18-10-5-4-6-11-18)19-12-9-13-20(16-19)25(26,27)28/h4-16H,17H2,1-3H3,(H2,30,31,32)
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n/an/a 8.30E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394960
PNG
(CHEMBL2165697)
Show SMILES FC(F)(F)c1cccc(c1)C(Cc1ccccc1)(NC(=O)c1ccccc1)c1ccccn1
Show InChI InChI=1S/C27H21F3N2O/c28-27(29,30)23-15-9-14-22(18-23)26(24-16-7-8-17-31-24,19-20-10-3-1-4-11-20)32-25(33)21-12-5-2-6-13-21/h1-18H,19H2,(H,32,33)
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n/an/a>9.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394956
PNG
(CHEMBL2165683)
Show SMILES Fc1cc(cc(c1)[C@](Cc1nnc[nH]1)(NC(=O)NC1CCCC1)c1ccc(Cl)cn1)C(F)(F)F
Show InChI InChI=1S/C22H21ClF4N6O/c23-15-5-6-18(28-11-15)21(10-19-29-12-30-33-19,32-20(34)31-17-3-1-2-4-17)13-7-14(22(25,26)27)9-16(24)8-13/h5-9,11-12,17H,1-4,10H2,(H,29,30,33)(H2,31,32,34)/t21-/m0/s1
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n/an/a>9.60E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CETP-mediated [3H]cholesteryl ester transfer from HDL to biotinylated LDL by scintillation proximity assay


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50394952
PNG
(CHEMBL2165694)
Show SMILES CC(C)(C)CC(=O)O[C@](Cc1ccccc1)(c1cccc(c1)C(F)(F)F)c1ccccn1
Show InChI InChI=1S/C26H26F3NO2/c1-24(2,3)18-23(31)32-25(22-14-7-8-15-30-22,17-19-10-5-4-6-11-19)20-12-9-13-21(16-20)26(27,28)29/h4-16H,17-18H2,1-3H3/t25-/m1/s1
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n/an/a>9.70E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated [3H]cholesteryl ester transfer activity in human plasma after 2.5 hrs by scintillation counter


J Med Chem 55: 6162-75 (2012)


Article DOI: 10.1021/jm300611v
BindingDB Entry DOI: 10.7270/Q2KH0PF5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%