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PubMed code 16386417

Compile data set for download or QSAR
Found 27 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
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179880
PNG
(1,1,1,3,3,3-hexafluoro-2-(1-(phenylsulfonyl)indoli...)
Show SMILES OC(c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H13F6NO3S/c18-16(19,20)15(25,17(21,22)23)12-6-7-14-11(10-12)8-9-24(14)28(26,27)13-4-2-1-3-5-13/h1-7,10,25H,8-9H2
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n/an/an/an/a 50n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179878
PNG
(CHEMBL206192 | N-(4-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccs1
Show InChI InChI=1S/C14H11F6NO3S2/c1-21(26(23,24)11-3-2-8-25-11)10-6-4-9(5-7-10)12(22,13(15,16)17)14(18,19)20/h2-8,22H,1H3
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n/an/an/an/a 600n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179872
PNG
(CHEMBL206674 | biphenyl-3-sulfonic acid methyl-[4-...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C22H17F6NO3S/c1-29(18-12-10-17(11-13-18)20(30,21(23,24)25)22(26,27)28)33(31,32)19-9-5-8-16(14-19)15-6-3-2-4-7-15/h2-14,30H,1H3
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n/an/an/an/a 30n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179877
PNG
(1,1,1,3,3,3-hexafluoro-2-(1-(phenylsulfonyl)-1,2,3...)
Show SMILES OC(c1ccc2N(CCCc2c1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C18H15F6NO3S/c19-17(20,21)16(26,18(22,23)24)13-8-9-15-12(11-13)5-4-10-25(15)29(27,28)14-6-2-1-3-7-14/h1-3,6-9,11,26H,4-5,10H2
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n/an/an/an/a 30n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179873
PNG
(CHEMBL204282 | N-(3-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES CN(c1cccc(c1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H13F6NO3S/c1-23(27(25,26)13-8-3-2-4-9-13)12-7-5-6-11(10-12)14(24,15(17,18)19)16(20,21)22/h2-10,24H,1H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179874
PNG
(CHEMBL380249 | N-(2-chloro-4-(1,1,1,3,3,3-hexafluo...)
Show SMILES CN(c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H12ClF6NO3S/c1-24(28(26,27)11-5-3-2-4-6-11)13-8-7-10(9-12(13)17)14(25,15(18,19)20)16(21,22)23/h2-9,25H,1H3
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n/an/an/an/a 200n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179875
PNG
(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-N-...)
Show SMILES CN(c1ccccc1)S(=O)(=O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C16H13F6NO3S/c1-23(12-5-3-2-4-6-12)27(25,26)13-9-7-11(8-10-13)14(24,15(17,18)19)16(20,21)22/h2-10,24H,1H3
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n/an/an/an/a 100n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179868
PNG
(CHEMBL203454 | N-methyl-N-(4-(2,2,2-trifluoro-1-hy...)
Show SMILES CN(c1ccc(cc1)C(O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C15H14F3NO3S/c1-19(23(21,22)13-5-3-2-4-6-13)12-9-7-11(8-10-12)14(20)15(16,17)18/h2-10,14,20H,1H3
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n/an/an/an/a>5.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179870
PNG
(CHEMBL206445 | N1-(4-(1,1,1,3,3,3-hexafluoro-2-hyd...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C16H14F6N2O5S2/c1-24(31(28,29)13-4-2-3-12(9-13)30(23,26)27)11-7-5-10(6-8-11)14(25,15(17,18)19)16(20,21)22/h2-9,25H,1H3,(H2,23,26,27)
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n/an/an/an/a 80n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179857
PNG
(4-cyano-N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxyprop...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(cc1)C#N
Show InChI InChI=1S/C17H12F6N2O3S/c1-25(29(27,28)14-8-2-11(10-24)3-9-14)13-6-4-12(5-7-13)15(26,16(18,19)20)17(21,22)23/h2-9,26H,1H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179863
PNG
(CHEMBL379225 | N-(4-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES CN(C(=O)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H13F6NO2/c1-24(14(25)11-5-3-2-4-6-11)13-9-7-12(8-10-13)15(26,16(18,19)20)17(21,22)23/h2-10,26H,1H3
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n/an/an/an/a 100n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179866
PNG
(CHEMBL380851 | N-(4-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccs1
Show InChI InChI=1S/C17H17F6NO3S2/c1-11(2)10-24(29(26,27)14-4-3-9-28-14)13-7-5-12(6-8-13)15(25,16(18,19)20)17(21,22)23/h3-9,11,25H,10H2,1-2H3
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n/an/an/an/a 40n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179876
PNG
(1,1,1,3,3,3-hexafluoro-2-(4-(phenylsulfonyl)-3,4-d...)
Show SMILES OC(c1ccc2N(CCOc2c1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H13F6NO4S/c18-16(19,20)15(25,17(21,22)23)11-6-7-13-14(10-11)28-9-8-24(13)29(26,27)12-4-2-1-3-5-12/h1-7,10,25H,8-9H2
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n/an/an/an/a 100n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179865
PNG
(2-cyano-N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxyprop...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1C#N
Show InChI InChI=1S/C17H12F6N2O3S/c1-25(29(27,28)14-5-3-2-4-11(14)10-24)13-8-6-12(7-9-13)15(26,16(18,19)20)17(21,22)23/h2-9,26H,1H3
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n/an/an/an/a 700n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179879
PNG
(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-N-...)
Show SMILES CN(C(=O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C17H13F6NO2/c1-24(13-5-3-2-4-6-13)14(25)11-7-9-12(10-8-11)15(26,16(18,19)20)17(21,22)23/h2-10,26H,1H3
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n/an/an/an/a 200n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179856
PNG
(CHEMBL205770 | N-(3-chloro-4-(1,1,1,3,3,3-hexafluo...)
Show SMILES CN(c1ccc(c(Cl)c1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H12ClF6NO3S/c1-24(28(26,27)11-5-3-2-4-6-11)10-7-8-12(13(17)9-10)14(25,15(18,19)20)16(21,22)23/h2-9,25H,1H3
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n/an/an/an/a>5.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179861
PNG
(CHEMBL380711 | N-(4-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES CN(Cc1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H15F6NO3S/c1-24(28(26,27)14-5-3-2-4-6-14)11-12-7-9-13(10-8-12)15(25,16(18,19)20)17(21,22)23/h2-10,25H,11H2,1H3
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n/an/an/an/a 3.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179864
PNG
(3-cyano-N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxyprop...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C17H12F6N2O3S/c1-25(29(27,28)14-4-2-3-11(9-14)10-24)13-7-5-12(6-8-13)15(26,16(18,19)20)17(21,22)23/h2-9,26H,1H3
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n/an/an/an/a 20n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179867
PNG
(CHEMBL382792 | N-(4-(1,1,1,3,3,3-hexafluoro-2-hydr...)
Show SMILES OC(c1ccc(NS(=O)(=O)c2ccccc2)cc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C15H11F6NO3S/c16-14(17,18)13(23,15(19,20)21)10-6-8-11(9-7-10)22-26(24,25)12-4-2-1-3-5-12/h1-9,22-23H
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n/an/an/an/a 4.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179859
PNG
(CHEMBL203606 | isobutyl 4-(1,1,1,3,3,3-hexafluoro-...)
Show SMILES CC(C)COC(=O)N(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C15H17F6NO3/c1-9(2)8-25-12(23)22(3)11-6-4-10(5-7-11)13(24,14(16,17)18)15(19,20)21/h4-7,9,24H,8H2,1-3H3
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n/an/an/an/a 100n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179860
PNG
(CHEMBL206738 | N-cyclopentyl-N-(4-(1,1,1,3,3,3-hex...)
Show SMILES OC(c1ccc(cc1)N(C1CCCC1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H19F6NO3S/c21-19(22,23)18(28,20(24,25)26)14-10-12-16(13-11-14)27(15-6-4-5-7-15)31(29,30)17-8-2-1-3-9-17/h1-3,8-13,15,28H,4-7H2
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n/an/an/an/a 8n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179869
PNG
(CHEMBL203682 | N-methyl-N-[4-(2,2,2-trifluoro-1-hy...)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H13F6NO3S/c1-23(27(25,26)13-5-3-2-4-6-13)12-9-7-11(8-10-12)14(24,15(17,18)19)16(20,21)22/h2-10,24H,1H3
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n/an/an/an/a 200n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179871
PNG
(CHEMBL383657 | N-methyl-N-(4-(1,1,1-trifluoro-2-hy...)
Show SMILES CN(c1ccc(cc1)C(C)(O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H16F3NO3S/c1-15(21,16(17,18)19)12-8-10-13(11-9-12)20(2)24(22,23)14-6-4-3-5-7-14/h3-11,21H,1-2H3
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n/an/an/an/a 5.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179858
PNG
(1,1,1,3,3,3-hexafluoro-2-(1-(phenylsulfonyl)-2,3,4...)
Show SMILES OC(c1ccc2N(CCCCc2c1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H17F6NO3S/c20-18(21,22)17(27,19(23,24)25)14-9-10-16-13(12-14)6-4-5-11-26(16)30(28,29)15-7-2-1-3-8-15/h1-3,7-10,12,27H,4-6,11H2
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n/an/an/an/a 10n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50179862
PNG
(CHEMBL203824 | N-(4-(1,1,1,3,3,3-hexafluoro-2-meth...)
Show SMILES COC(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H15F6NO3S/c1-24(28(25,26)14-6-4-3-5-7-14)13-10-8-12(9-11-13)15(27-2,16(18,19)20)17(21,22)23/h3-11H,1-2H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM20164
PNG
((1S,2R,5S,10S,11S,14R,15R)-14-[(2R)-4-[(2S)-3,3-di...)
Show SMILES C[C@H](CC[C@@H]1OC1(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
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n/an/an/an/a 500n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM19993
PNG
(CHEMBL62136 | N-[4-(1,1,1,3,3,3-hexafluoro-2-hydro...)
Show SMILES OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H12F9NO3S/c18-14(19,20)10-27(31(29,30)13-4-2-1-3-5-13)12-8-6-11(7-9-12)15(28,16(21,22)23)17(24,25)26/h1-9,28H,10H2
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n/an/an/an/a 10n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activity against LXR alpha transiently transfected in HEK293 cells


Bioorg Med Chem Lett 16: 1638-42 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.015
BindingDB Entry DOI: 10.7270/Q21J99B2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
* indicates data uncertainty>20%