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PubMed code 22901900

Compile data set for download or QSAR
Found 92 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
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390768
PNG
(CHEMBL2070466)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C29H28F3NO5S2/c1-39(35,36)26-17-11-22(12-18-26)19-20-28(34,29(30,31)32)24-13-15-25(16-14-24)33(21-23-7-5-6-8-23)40(37,38)27-9-3-2-4-10-27/h2-4,9-18,23,34H,5-8,21H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390722
PNG
(CHEMBL2070345)
Show SMILES CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H13F8NO3S/c1-26(30(28,29)13-5-3-2-4-6-13)12-9-7-11(8-10-12)14(27,16(20,21)22)15(18,19)17(23,24)25/h2-10,27H,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390742
PNG
(CHEMBL2070365)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C27H23F3N2O3S/c1-20(2)19-32(36(34,35)25-10-6-9-22(17-25)18-31)24-13-11-23(12-14-24)26(33,27(28,29)30)16-15-21-7-4-3-5-8-21/h3-14,17,20,33H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390767
PNG
(CHEMBL2070465)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C28H26F3NO5S2/c1-38(34,35)25-16-10-21(11-17-25)18-19-27(33,28(29,30)31)23-12-14-24(15-13-23)32(20-22-6-5-7-22)39(36,37)26-8-3-2-4-9-26/h2-4,8-17,22,33H,5-7,20H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390756
PNG
(CHEMBL2070454)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H25F3N2O5S2/c1-20(2)19-33(40(37,38)26-9-5-7-22(17-26)18-32)24-12-10-23(11-13-24)27(34,28(29,30)31)15-14-21-6-4-8-25(16-21)39(3,35)36/h4-13,16-17,20,34H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390738
PNG
(CHEMBL2070361)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccnc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H23F3N2O3S/c1-19(2)18-30(34(32,33)23-8-4-3-5-9-23)22-12-10-21(11-13-22)24(31,25(26,27)28)15-14-20-7-6-16-29-17-20/h3-13,16-17,19,31H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390745
PNG
(CHEMBL2070368)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F6NO3S/c1-19(2)18-34(38(36,37)24-9-4-3-5-10-24)23-13-11-21(12-14-23)25(35,27(31,32)33)16-15-20-7-6-8-22(17-20)26(28,29)30/h3-14,17,19,35H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390764
PNG
(CHEMBL2070462)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CCC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C26H21F6NO5S2/c1-39(35,36)22-13-7-19(8-14-22)15-16-24(34,26(30,31)32)20-9-11-21(12-10-20)33(18-17-25(27,28)29)40(37,38)23-5-3-2-4-6-23/h2-14,34H,17-18H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390765
PNG
(CHEMBL2070464)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H24F3NO5S2/c1-37(33,34)24-15-9-20(10-16-24)17-18-26(32,27(28,29)30)22-11-13-23(14-12-22)31(19-21-7-8-21)38(35,36)25-5-3-2-4-6-25/h2-6,9-16,21,32H,7-8,19H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390762
PNG
(CHEMBL2070460)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H23F3N2O5S/c1-19(2)18-33(39(37,38)25-5-3-4-21(16-25)17-32)24-12-10-23(11-13-24)27(36,28(29,30)31)15-14-20-6-8-22(9-7-20)26(34)35/h3-13,16,19,36H,18H2,1-2H3,(H,34,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390757
PNG
(CHEMBL2070455)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO5S2/c1-20(2)19-31(38(35,36)25-7-5-4-6-8-25)23-13-11-22(12-14-23)26(32,27(28,29)30)18-17-21-9-15-24(16-10-21)37(3,33)34/h4-16,20,32H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390744
PNG
(CHEMBL2070367)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(Cl)cc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C27H22ClF3N2O3S/c1-19(2)18-33(37(35,36)25-5-3-4-21(16-25)17-32)24-12-8-22(9-13-24)26(34,27(29,30)31)15-14-20-6-10-23(28)11-7-20/h3-13,16,19,34H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390735
PNG
(CHEMBL2070358)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CCc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO3S/c1-21(2)20-31(35(33,34)25-13-7-4-8-14-25)24-17-15-23(16-18-24)26(32,27(28,29)30)19-9-12-22-10-5-3-6-11-22/h3-8,10-11,13-18,21,32H,12,20H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390749
PNG
(CHEMBL2070448)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(C)cc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO3S/c1-20(2)19-31(35(33,34)25-7-5-4-6-8-25)24-15-13-23(14-16-24)26(32,27(28,29)30)18-17-22-11-9-21(3)10-12-22/h4-16,20,32H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390754
PNG
(CHEMBL2070452)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C#N)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H22F3N3O3S/c1-20(2)19-34(38(36,37)26-5-3-4-23(16-26)18-33)25-12-10-24(11-13-25)27(35,28(29,30)31)15-14-21-6-8-22(17-32)9-7-21/h3-13,16,20,35H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390733
PNG
(CHEMBL2070356)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H24F3NO3S/c1-20(2)19-30(34(32,33)24-11-7-4-8-12-24)23-15-13-22(14-16-23)25(31,26(27,28)29)18-17-21-9-5-3-6-10-21/h3-16,20,31H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390758
PNG
(CHEMBL2070456)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H25F3N2O5S2/c1-20(2)19-33(40(37,38)26-6-4-5-22(17-26)18-32)24-11-9-23(10-12-24)27(34,28(29,30)31)16-15-21-7-13-25(14-8-21)39(3,35)36/h4-14,17,20,34H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390755
PNG
(CHEMBL2070453)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO5S2/c1-20(2)19-31(38(35,36)24-9-5-4-6-10-24)23-14-12-22(13-15-23)26(32,27(28,29)30)17-16-21-8-7-11-25(18-21)37(3,33)34/h4-15,18,20,32H,19H2,1-3H3
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n/an/a 600n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390753
PNG
(CHEMBL2070451)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C#N)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F3N2O3S/c1-20(2)19-32(36(34,35)25-9-4-3-5-10-25)24-13-11-23(12-14-24)26(33,27(28,29)30)16-15-21-7-6-8-22(17-21)18-31/h3-14,17,20,33H,19H2,1-2H3
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n/an/a 600n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390748
PNG
(CHEMBL2070372)
Show SMILES CCOc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C28H28F3NO4S/c1-4-36-25-16-10-22(11-17-25)18-19-27(33,28(29,30)31)23-12-14-24(15-13-23)32(20-21(2)3)37(34,35)26-8-6-5-7-9-26/h5-17,21,33H,4,20H2,1-3H3
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n/an/a 700n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390747
PNG
(CHEMBL2070371)
Show SMILES COc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H26F3NO4S/c1-20(2)19-31(36(33,34)25-7-5-4-6-8-25)23-13-11-22(12-14-23)26(32,27(28,29)30)18-17-21-9-15-24(35-3)16-10-21/h4-16,20,32H,19H2,1-3H3
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n/an/a 700n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390751
PNG
(CHEMBL2070450)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(F)cc1F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H22F5NO3S/c1-18(2)17-32(36(34,35)23-6-4-3-5-7-23)22-12-9-20(10-13-22)25(33,26(29,30)31)15-14-19-8-11-21(27)16-24(19)28/h3-13,16,18,33H,17H2,1-2H3
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n/an/a 800n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390769
PNG
(CHEMBL2070370)
Show SMILES COc1cccc(c1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H26F3NO4S/c1-20(2)19-31(36(33,34)25-10-5-4-6-11-25)23-14-12-22(13-15-23)26(32,27(28,29)30)17-16-21-8-7-9-24(18-21)35-3/h4-15,18,20,32H,19H2,1-3H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390763
PNG
(CHEMBL2070461)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C25H19F6NO5S2/c1-38(34,35)21-13-7-18(8-14-21)15-16-23(33,25(29,30)31)19-9-11-20(12-10-19)32(17-24(26,27)28)39(36,37)22-5-3-2-4-6-22/h2-14,33H,17H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390736
PNG
(CHEMBL2070359)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC1=CCCCC1)C(F)(F)F)S(=O)(=O)c1ccccc1 |t:16|
Show InChI InChI=1S/C26H28F3NO3S/c1-20(2)19-30(34(32,33)24-11-7-4-8-12-24)23-15-13-22(14-16-23)25(31,26(27,28)29)18-17-21-9-5-3-6-10-21/h4,7-9,11-16,20,31H,3,5-6,10,19H2,1-2H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390734
PNG
(CHEMBL2070357)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H28F3NO3S/c1-18(2)17-28(32(30,31)21-9-7-6-8-10-21)20-13-11-19(12-14-20)23(29,24(25,26)27)16-15-22(3,4)5/h6-14,18,29H,17H2,1-5H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390732
PNG
(CHEMBL2070355)
Show SMILES OC(C#Cc1ccc(F)cc1)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C24H16F7NO3S/c25-19-10-6-17(7-11-19)14-15-22(33,24(29,30)31)18-8-12-20(13-9-18)32(16-23(26,27)28)36(34,35)21-4-2-1-3-5-21/h1-13,33H,16H2
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n/an/a 1.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390766
PNG
(CHEMBL2070463)
Show SMILES CC(C)(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H28F3NO5S2/c1-26(2,3)20-32(39(36,37)25-8-6-5-7-9-25)23-14-12-22(13-15-23)27(33,28(29,30)31)19-18-21-10-16-24(17-11-21)38(4,34)35/h5-17,33H,20H2,1-4H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390743
PNG
(CHEMBL2070366)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C26H22Cl2F3NO3S/c1-18(2)17-32(36(34,35)24-16-21(27)10-13-23(24)28)22-11-8-20(9-12-22)25(33,26(29,30)31)15-14-19-6-4-3-5-7-19/h3-13,16,18,33H,17H2,1-2H3
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n/an/a 1.40E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390731
PNG
(CHEMBL2070354)
Show SMILES CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C23H18F3NO3S/c1-27(31(29,30)21-10-6-3-7-11-21)20-14-12-19(13-15-20)22(28,23(24,25)26)17-16-18-8-4-2-5-9-18/h2-15,28H,1H3
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n/an/a 1.40E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390724
PNG
(CHEMBL2070347)
Show SMILES CN(c1ccc(cc1)C(O)(c1cccs1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C19H16F3NO3S2/c1-23(28(25,26)16-6-3-2-4-7-16)15-11-9-14(10-12-15)18(24,19(20,21)22)17-8-5-13-27-17/h2-13,24H,1H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390768
PNG
(CHEMBL2070466)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C29H28F3NO5S2/c1-39(35,36)26-17-11-22(12-18-26)19-20-28(34,29(30,31)32)24-13-15-25(16-14-24)33(21-23-7-5-6-8-23)40(37,38)27-9-3-2-4-10-27/h2-4,9-18,23,34H,5-8,21H2,1H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390741
PNG
(CHEMBL2070364)
Show SMILES CCn1cc(cn1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3N3O3S/c1-4-30-18-20(16-29-30)14-15-24(32,25(26,27)28)21-10-12-22(13-11-21)31(17-19(2)3)35(33,34)23-8-6-5-7-9-23/h5-13,16,18-19,32H,4,17H2,1-3H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390761
PNG
(CHEMBL2070459)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H24F3NO5S/c1-19(2)18-31(37(35,36)24-9-4-3-5-10-24)23-13-11-22(12-14-23)26(34,27(28,29)30)16-15-20-7-6-8-21(17-20)25(32)33/h3-14,17,19,34H,18H2,1-2H3,(H,32,33)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390757
PNG
(CHEMBL2070455)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO5S2/c1-20(2)19-31(38(35,36)25-7-5-4-6-8-25)23-13-11-22(12-14-23)26(32,27(28,29)30)18-17-21-9-15-24(16-10-21)37(3,33)34/h4-16,20,32H,19H2,1-3H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390758
PNG
(CHEMBL2070456)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H25F3N2O5S2/c1-20(2)19-33(40(37,38)26-6-4-5-22(17-26)18-32)24-11-9-23(10-12-24)27(34,28(29,30)31)16-15-21-7-13-25(14-8-21)39(3,35)36/h4-14,17,20,34H,19H2,1-3H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390765
PNG
(CHEMBL2070464)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H24F3NO5S2/c1-37(33,34)24-15-9-20(10-16-24)17-18-26(32,27(28,29)30)22-11-13-23(14-12-22)31(19-21-7-8-21)38(35,36)25-5-3-2-4-6-25/h2-6,9-16,21,32H,7-8,19H2,1H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor 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/a 2.20E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390746
PNG
(CHEMBL2070369)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F6NO3S/c1-19(2)18-34(38(36,37)24-6-4-3-5-7-24)23-14-12-21(13-15-23)25(35,27(31,32)33)17-16-20-8-10-22(11-9-20)26(28,29)30/h3-15,19,35H,18H2,1-2H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390752
PNG
(CHEMBL2069319)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1C)[N+]([O-])=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H25F3N2O5S/c1-19(2)18-31(38(36,37)25-7-5-4-6-8-25)23-13-10-22(11-14-23)26(33,27(28,29)30)16-15-21-9-12-24(32(34)35)17-20(21)3/h4-14,17,19,33H,18H2,1-3H3
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n/an/a 2.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390740
PNG
(CHEMBL2070363)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1c(C)noc1C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H25F3N2O4S/c1-17(2)16-30(35(32,33)22-8-6-5-7-9-22)21-12-10-20(11-13-21)24(31,25(26,27)28)15-14-23-18(3)29-34-19(23)4/h5-13,17,31H,16H2,1-4H3
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n/an/a 3.20E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390750
PNG
(CHEMBL2070449)
Show SMILES CCCCc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C30H32F3NO3S/c1-4-5-9-24-12-14-25(15-13-24)20-21-29(35,30(31,32)33)26-16-18-27(19-17-26)34(22-23(2)3)38(36,37)28-10-7-6-8-11-28/h6-8,10-19,23,35H,4-5,9,22H2,1-3H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390725
PNG
(CHEMBL2070348)
Show SMILES CN(c1ccc(cc1)C(O)(c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H18F3NO3S/c1-25(29(27,28)19-10-6-3-7-11-19)18-14-12-17(13-15-18)20(26,21(22,23)24)16-8-4-2-5-9-16/h2-15,26H,1H3
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n/an/a 3.60E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390737
PNG
(CHEMBL2070360)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccn1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H23F3N2O3S/c1-19(2)18-30(34(32,33)23-9-4-3-5-10-23)22-13-11-20(12-14-22)24(31,25(26,27)28)16-15-21-8-6-7-17-29-21/h3-14,17,19,31H,18H2,1-2H3
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n/an/a 3.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390764
PNG
(CHEMBL2070462)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CCC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C26H21F6NO5S2/c1-39(35,36)22-13-7-19(8-14-22)15-16-24(34,26(30,31)32)20-9-11-21(12-10-20)33(18-17-25(27,28)29)40(37,38)23-5-3-2-4-6-23/h2-14,34H,17-18H2,1H3
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n/an/a 4.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390729
PNG
(CHEMBL2070352)
Show SMILES CN(c1ccc(cc1)C(O)(C#CC(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H13F6NO3S/c1-25(29(27,28)15-5-3-2-4-6-15)14-9-7-13(8-10-14)16(26,18(22,23)24)11-12-17(19,20)21/h2-10,26H,1H3
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n/an/a 4.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390759
PNG
(CHEMBL2070457)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H22F6N2O5S2/c1-19(2)18-36(43(40,41)25-5-3-4-21(16-25)17-35)23-10-8-22(9-11-23)26(37,27(29,30)31)15-14-20-6-12-24(13-7-20)42(38,39)28(32,33)34/h3-13,16,19,37H,18H2,1-2H3
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n/an/a 4.30E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390755
PNG
(CHEMBL2070453)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO5S2/c1-20(2)19-31(38(35,36)24-9-5-4-6-10-24)23-14-12-22(13-15-23)26(32,27(28,29)30)17-16-21-8-7-11-25(18-21)37(3,33)34/h4-15,18,20,32H,19H2,1-3H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390739
PNG
(CHEMBL2070362)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cncn1C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H24F3N3O3S/c1-18(2)16-30(34(32,33)22-7-5-4-6-8-22)20-11-9-19(10-12-20)23(31,24(25,26)27)14-13-21-15-28-17-29(21)3/h4-12,15,17-18,31H,16H2,1-3H3
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n/an/a 5.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390766
PNG
(CHEMBL2070463)
Show SMILES CC(C)(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H28F3NO5S2/c1-26(2,3)20-32(39(36,37)25-8-6-5-7-9-25)23-14-12-22(13-15-23)27(33,28(29,30)31)19-18-21-10-16-24(17-11-21)38(4,34)35/h5-17,33H,20H2,1-4H3
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n/an/a 6.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390767
PNG
(CHEMBL2070465)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C28H26F3NO5S2/c1-38(34,35)25-16-10-21(11-17-25)18-19-27(33,28(29,30)31)23-12-14-24(15-13-23)32(20-22-6-5-7-22)39(36,37)26-8-3-2-4-9-26/h2-4,8-17,22,33H,5-7,20H2,1H3
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n/an/a 7.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390756
PNG
(CHEMBL2070454)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H25F3N2O5S2/c1-20(2)19-33(40(37,38)26-9-5-7-22(17-26)18-32)24-12-10-23(11-13-24)27(34,28(29,30)31)15-14-21-6-4-8-25(16-21)39(3,35)36/h4-13,16-17,20,34H,19H2,1-3H3
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n/an/a 7.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390726
PNG
(CHEMBL2070349)
Show SMILES CN(c1ccc(cc1)C(O)(c1nccs1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H15F3N2O3S2/c1-23(28(25,26)15-5-3-2-4-6-15)14-9-7-13(8-10-14)17(24,18(19,20)21)16-22-11-12-27-16/h2-12,24H,1H3
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n/an/a 7.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390733
PNG
(CHEMBL2070356)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H24F3NO3S/c1-20(2)19-30(34(32,33)24-11-7-4-8-12-24)23-15-13-22(14-16-23)25(31,26(27,28)29)18-17-21-9-5-3-6-10-21/h3-16,20,31H,19H2,1-2H3
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n/an/a 8.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390751
PNG
(CHEMBL2070450)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(F)cc1F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H22F5NO3S/c1-18(2)17-32(36(34,35)23-6-4-3-5-7-23)22-12-9-20(10-13-22)25(33,26(29,30)31)15-14-19-8-11-21(27)16-24(19)28/h3-13,16,18,33H,17H2,1-2H3
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n/an/a 8.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390763
PNG
(CHEMBL2070461)
Show SMILES CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C25H19F6NO5S2/c1-38(34,35)21-13-7-18(8-14-21)15-16-23(33,25(29,30)31)19-9-11-20(12-10-19)32(17-24(26,27)28)39(36,37)22-5-3-2-4-6-22/h2-14,33H,17H2,1H3
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n/an/a 9.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390727
PNG
(CHEMBL2070350)
Show SMILES CN(c1ccc(cc1)C(O)(c1ncc[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H16F3N3O3S/c1-24(28(26,27)15-5-3-2-4-6-15)14-9-7-13(8-10-14)17(25,18(19,20)21)16-22-11-12-23-16/h2-12,25H,1H3,(H,22,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390749
PNG
(CHEMBL2070448)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(C)cc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO3S/c1-20(2)19-31(35(33,34)25-7-5-4-6-8-25)24-15-13-23(14-16-24)26(32,27(28,29)30)18-17-22-11-9-21(3)10-12-22/h4-16,20,32H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390759
PNG
(CHEMBL2070457)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H22F6N2O5S2/c1-19(2)18-36(43(40,41)25-5-3-4-21(16-25)17-35)23-10-8-22(9-11-23)26(37,27(29,30)31)15-14-20-6-12-24(13-7-20)42(38,39)28(32,33)34/h3-13,16,19,37H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390752
PNG
(CHEMBL2069319)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1C)[N+]([O-])=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H25F3N2O5S/c1-19(2)18-31(38(36,37)25-7-5-4-6-8-25)23-13-10-22(11-14-23)26(33,27(28,29)30)16-15-21-9-12-24(32(34)35)17-20(21)3/h4-14,17,19,33H,18H2,1-3H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390760
PNG
(CHEMBL2070458)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)c1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C33H27F3N2O5S2/c1-24(2)23-38(45(42,43)31-10-6-7-26(21-31)22-37)28-15-13-27(14-16-28)32(39,33(34,35)36)20-19-25-11-17-30(18-12-25)44(40,41)29-8-4-3-5-9-29/h3-18,21,24,39H,23H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390731
PNG
(CHEMBL2070354)
Show SMILES CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C23H18F3NO3S/c1-27(31(29,30)21-10-6-3-7-11-21)20-14-12-19(13-15-20)22(28,23(24,25)26)17-16-18-8-4-2-5-9-18/h2-15,28H,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390739
PNG
(CHEMBL2070362)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cncn1C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H24F3N3O3S/c1-18(2)16-30(34(32,33)22-7-5-4-6-8-22)20-11-9-19(10-12-20)23(31,24(25,26)27)14-13-21-15-28-17-29(21)3/h4-12,15,17-18,31H,16H2,1-3H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390748
PNG
(CHEMBL2070372)
Show SMILES CCOc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C28H28F3NO4S/c1-4-36-25-16-10-22(11-17-25)18-19-27(33,28(29,30)31)23-12-14-24(15-13-23)32(20-21(2)3)37(34,35)26-8-6-5-7-9-26/h5-17,21,33H,4,20H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390735
PNG
(CHEMBL2070358)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CCc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H26F3NO3S/c1-21(2)20-31(35(33,34)25-13-7-4-8-14-25)24-17-15-23(16-18-24)26(32,27(28,29)30)19-9-12-22-10-5-3-6-11-22/h3-8,10-11,13-18,21,32H,12,20H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor 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/a>1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390741
PNG
(CHEMBL2070364)
Show SMILES CCn1cc(cn1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3N3O3S/c1-4-30-18-20(16-29-30)14-15-24(32,25(26,27)28)21-10-12-22(13-11-21)31(17-19(2)3)35(33,34)23-8-6-5-7-9-23/h5-13,16,18-19,32H,4,17H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390770
PNG
(CHEMBL2069318)
Show SMILES CN(c1ccc(cc1)C(O)(c1nnn[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H14F3N5O3S/c1-24(28(26,27)13-5-3-2-4-6-13)12-9-7-11(8-10-12)15(25,16(17,18)19)14-20-22-23-21-14/h2-10,25H,1H3,(H,20,21,22,23)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390760
PNG
(CHEMBL2070458)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)c1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C33H27F3N2O5S2/c1-24(2)23-38(45(42,43)31-10-6-7-26(21-31)22-37)28-15-13-27(14-16-28)32(39,33(34,35)36)20-19-25-11-17-30(18-12-25)44(40,41)29-8-4-3-5-9-29/h3-18,21,24,39H,23H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390747
PNG
(CHEMBL2070371)
Show SMILES COc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H26F3NO4S/c1-20(2)19-31(36(33,34)25-7-5-4-6-8-25)23-13-11-22(12-14-23)26(32,27(28,29)30)18-17-21-9-15-24(35-3)16-10-21/h4-16,20,32H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390734
PNG
(CHEMBL2070357)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H28F3NO3S/c1-18(2)17-28(32(30,31)21-9-7-6-8-10-21)20-13-11-19(12-14-20)23(29,24(25,26)27)16-15-22(3,4)5/h6-14,18,29H,17H2,1-5H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390744
PNG
(CHEMBL2070367)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(Cl)cc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C27H22ClF3N2O3S/c1-19(2)18-33(37(35,36)25-5-3-4-21(16-25)17-32)24-12-8-22(9-13-24)26(34,27(29,30)31)15-14-20-6-10-23(28)11-7-20/h3-13,16,19,34H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390740
PNG
(CHEMBL2070363)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1c(C)noc1C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H25F3N2O4S/c1-17(2)16-30(35(32,33)22-8-6-5-7-9-22)21-12-10-20(11-13-21)24(31,25(26,27)28)15-14-23-18(3)29-34-19(23)4/h5-13,17,31H,16H2,1-4H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390754
PNG
(CHEMBL2070452)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C#N)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H22F3N3O3S/c1-20(2)19-34(38(36,37)26-5-3-4-23(16-26)18-33)25-12-10-24(11-13-25)27(35,28(29,30)31)15-14-21-6-8-22(17-32)9-7-21/h3-13,16,20,35H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390750
PNG
(CHEMBL2070449)
Show SMILES CCCCc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C30H32F3NO3S/c1-4-5-9-24-12-14-25(15-13-24)20-21-29(35,30(31,32)33)26-16-18-27(19-17-26)34(22-23(2)3)38(36,37)28-10-7-6-8-11-28/h6-8,10-19,23,35H,4-5,9,22H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390742
PNG
(CHEMBL2070365)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C27H23F3N2O3S/c1-20(2)19-32(36(34,35)25-10-6-9-22(17-25)18-31)24-13-11-23(12-14-24)26(33,27(28,29)30)16-15-21-7-4-3-5-8-21/h3-14,17,20,33H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390737
PNG
(CHEMBL2070360)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccn1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H23F3N2O3S/c1-19(2)18-30(34(32,33)23-9-4-3-5-10-23)22-13-11-20(12-14-22)24(31,25(26,27)28)16-15-21-8-6-7-17-29-21/h3-14,17,19,31H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390729
PNG
(CHEMBL2070352)
Show SMILES CN(c1ccc(cc1)C(O)(C#CC(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H13F6NO3S/c1-25(29(27,28)15-5-3-2-4-6-15)14-9-7-13(8-10-14)16(26,18(22,23)24)11-12-17(19,20)21/h2-10,26H,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390723
PNG
(CHEMBL2070346)
Show SMILES CN(c1ccc(cc1)C(O)(Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C22H20F3NO3S/c1-26(30(28,29)20-10-6-3-7-11-20)19-14-12-18(13-15-19)21(27,22(23,24)25)16-17-8-4-2-5-9-17/h2-15,27H,16H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390769
PNG
(CHEMBL2070370)
Show SMILES COc1cccc(c1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C27H26F3NO4S/c1-20(2)19-31(36(33,34)25-10-5-4-6-11-25)23-14-12-22(13-15-23)26(32,27(28,29)30)17-16-21-8-7-9-24(18-21)35-3/h4-15,18,20,32H,19H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390761
PNG
(CHEMBL2070459)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H24F3NO5S/c1-19(2)18-31(37(35,36)24-9-4-3-5-10-24)23-13-11-22(12-14-23)26(34,27(28,29)30)16-15-20-7-6-8-21(17-20)25(32)33/h3-14,17,19,34H,18H2,1-2H3,(H,32,33)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390753
PNG
(CHEMBL2070451)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C#N)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F3N2O3S/c1-20(2)19-32(36(34,35)25-9-4-3-5-10-25)24-13-11-23(12-14-24)26(33,27(28,29)30)16-15-21-7-6-8-22(17-21)18-31/h3-14,17,20,33H,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390736
PNG
(CHEMBL2070359)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC1=CCCCC1)C(F)(F)F)S(=O)(=O)c1ccccc1 |t:16|
Show InChI InChI=1S/C26H28F3NO3S/c1-20(2)19-30(34(32,33)24-11-7-4-8-12-24)23-15-13-22(14-16-23)25(31,26(27,28)29)18-17-21-9-5-3-6-10-21/h4,7-9,11-16,20,31H,3,5-6,10,19H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor 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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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390728
PNG
(CHEMBL2070351)
Show SMILES CN(c1ccc(cc1)C(O)(c1nnc[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H15F3N4O3S/c1-24(28(26,27)14-5-3-2-4-6-14)13-9-7-12(8-10-13)16(25,17(18,19)20)15-21-11-22-23-15/h2-11,25H,1H3,(H,21,22,23)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390738
PNG
(CHEMBL2070361)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccnc1)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H23F3N2O3S/c1-19(2)18-30(34(32,33)23-8-4-3-5-9-23)22-12-10-21(11-13-22)24(31,25(26,27)28)15-14-20-7-6-16-29-17-20/h3-13,16-17,19,31H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390732
PNG
(CHEMBL2070355)
Show SMILES OC(C#Cc1ccc(F)cc1)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C24H16F7NO3S/c25-19-10-6-17(7-11-19)14-15-22(33,24(29,30)31)18-8-12-20(13-9-18)32(16-23(26,27)28)36(34,35)21-4-2-1-3-5-21/h1-13,33H,16H2
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390745
PNG
(CHEMBL2070368)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F6NO3S/c1-19(2)18-34(38(36,37)24-9-4-3-5-10-24)23-13-11-21(12-14-23)25(35,27(31,32)33)16-15-20-7-6-8-22(17-20)26(28,29)30/h3-14,17,19,35H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390746
PNG
(CHEMBL2070369)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H23F6NO3S/c1-19(2)18-34(38(36,37)24-6-4-3-5-7-24)23-14-12-21(13-15-23)25(35,27(31,32)33)17-16-20-8-10-22(11-9-20)26(28,29)30/h3-15,19,35H,18H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390743
PNG
(CHEMBL2070366)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C26H22Cl2F3NO3S/c1-18(2)17-32(36(34,35)24-16-21(27)10-13-23(24)28)22-11-8-20(9-12-22)25(33,26(29,30)31)15-14-19-6-4-3-5-7-19/h3-13,16,18,33H,17H2,1-2H3
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390762
PNG
(CHEMBL2070460)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
Show InChI InChI=1S/C28H23F3N2O5S/c1-19(2)18-33(39(37,38)25-5-3-4-21(16-25)17-32)24-12-10-23(11-13-24)27(36,28(29,30)31)15-14-20-6-8-22(9-7-20)26(34)35/h3-13,16,19,36H,18H2,1-2H3,(H,34,35)
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))		BDBM50390730
PNG
(CHEMBL2070353)
Show SMILES CC(C)CC#CC(O)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C21H22F3NO3S/c1-16(2)8-7-15-20(26,21(22,23)24)17-11-13-18(14-12-17)25(3)29(27,28)19-9-5-4-6-10-19/h4-6,9-14,16,26H,8H2,1-3H3
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a>3.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...

Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%