Found 62 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306072
(2-isobutyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)...)Show SMILES CC(C)Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C25H23F3N2O3S/c1-16(2)13-23-29-24-21(25(26,27)28)11-6-12-22(24)30(23)17-7-4-8-18(14-17)33-19-9-5-10-20(15-19)34(3,31)32/h4-12,14-16H,13H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306070
(2-isopropyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)c1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C24H21F3N2O3S/c1-15(2)23-28-22-20(24(25,26)27)11-6-12-21(22)29(23)16-7-4-8-17(13-16)32-18-9-5-10-19(14-18)33(3,30)31/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50305077
(3-methyl-4-(3-(3-(methylsulfonyl)phenoxy)phenyl)-8...)Show SMILES Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C24H18F3NO3S/c1-15-14-28-23-20(10-5-11-21(23)24(25,26)27)22(15)16-6-3-7-17(12-16)31-18-8-4-9-19(13-18)32(2,29)30/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306073
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-2-phenyl-4...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)-c2ccccc2)c1 Show InChI InChI=1S/C27H19F3N2O3S/c1-36(33,34)22-13-6-12-21(17-22)35-20-11-5-10-19(16-20)32-24-15-7-14-23(27(28,29)30)25(24)31-26(32)18-8-3-2-4-9-18/h2-17H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306074
(2-(4-fluorobenzyl)-1-(3-(3-(methylsulfonyl)phenoxy...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(Cc3ccc(F)cc3)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C28H20F4N2O3S/c1-38(35,36)23-8-3-7-22(17-23)37-21-6-2-5-20(16-21)34-25-10-4-9-24(28(30,31)32)27(25)33-26(34)15-18-11-13-19(29)14-12-18/h2-14,16-17H,15H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306068
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-2,4-bis(tr...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C(F)(F)F)c1 Show InChI InChI=1S/C22H14F6N2O3S/c1-34(31,32)16-8-3-7-15(12-16)33-14-6-2-5-13(11-14)30-18-10-4-9-17(21(23,24)25)19(18)29-20(30)22(26,27)28/h2-12H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306075
(4-chloro-2-isopropyl-1-(3-(3-(methylsulfonyl)pheno...)Show SMILES CC(C)c1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C23H21ClN2O3S/c1-15(2)23-25-22-20(24)11-6-12-21(22)26(23)16-7-4-8-17(13-16)29-18-9-5-10-19(14-18)30(3,27)28/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306069
(2-ethyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4-...)Show SMILES CCc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C23H19F3N2O3S/c1-3-21-27-22-19(23(24,25)26)11-6-12-20(22)28(21)15-7-4-8-16(13-15)31-17-9-5-10-18(14-17)32(2,29)30/h4-14H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50305077
(3-methyl-4-(3-(3-(methylsulfonyl)phenoxy)phenyl)-8...)Show SMILES Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C24H18F3NO3S/c1-15-14-28-23-20(10-5-11-21(23)24(25,26)27)22(15)16-6-3-7-17(12-16)31-18-8-4-9-19(13-18)32(2,29)30/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306077
(1-(2-chloro-5-(3-(ethylsulfonyl)phenoxy)phenyl)-4-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C22H16ClF3N2O3S/c1-2-32(29,30)16-6-3-5-14(11-16)31-15-9-10-18(23)20(12-15)28-13-27-21-17(22(24,25)26)7-4-8-19(21)28/h3-13H,2H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306074
(2-(4-fluorobenzyl)-1-(3-(3-(methylsulfonyl)phenoxy...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(Cc3ccc(F)cc3)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C28H20F4N2O3S/c1-38(35,36)23-8-3-7-22(17-23)37-21-6-2-5-20(16-21)34-25-10-4-9-24(28(30,31)32)27(25)33-26(34)15-18-11-13-19(29)14-12-18/h2-14,16-17H,15H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306076
(1-(2-chloro-5-(3-(methylsulfonyl)phenoxy)phenyl)-4...)Show SMILES CS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C21H14ClF3N2O3S/c1-31(28,29)15-5-2-4-13(10-15)30-14-8-9-17(22)19(11-14)27-12-26-20-16(21(23,24)25)6-3-7-18(20)27/h2-12H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306072
(2-isobutyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)...)Show SMILES CC(C)Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C25H23F3N2O3S/c1-16(2)13-23-29-24-21(25(26,27)28)11-6-12-22(24)30(23)17-7-4-8-18(14-17)33-19-9-5-10-20(15-19)34(3,31)32/h4-12,14-16H,13H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306080
(4-chloro-1-(2-chloro-5-(3-(ethylsulfonyl)phenoxy)p...)Show SMILES CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(3.48,-43.65,;2.14,-44.41,;.82,-43.64,;1.9,-42.55,;-.28,-42.55,;-.5,-44.43,;-.48,-45.97,;-1.81,-46.75,;-3.15,-46,;-3.15,-44.46,;-4.49,-43.71,;-5.82,-44.49,;-7.16,-43.73,;-8.5,-44.52,;-8.48,-46.06,;-9.8,-46.84,;-7.14,-46.81,;-5.8,-46.03,;-7.12,-48.35,;-6.22,-49.6,;-4.68,-49.6,;-7.12,-50.85,;-8.59,-50.37,;-9.92,-51.15,;-9.91,-52.69,;-11.26,-50.38,;-11.26,-48.84,;-9.92,-48.07,;-8.59,-48.83,;-1.84,-43.68,)| Show InChI InChI=1S/C22H18Cl2N2O3S/c1-3-30(27,28)17-7-4-6-15(12-17)29-16-10-11-18(23)21(13-16)26-14(2)25-22-19(24)8-5-9-20(22)26/h4-13H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306081
(4-chloro-1-(2-chloro-5-(3-(isopropylsulfonyl)pheno...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(17.87,-44.13,;16.53,-44.9,;16.53,-46.44,;15.21,-44.13,;16.29,-43.03,;14.11,-43.03,;13.89,-44.92,;13.91,-46.46,;12.58,-47.24,;11.24,-46.49,;11.23,-44.95,;9.89,-44.19,;8.57,-44.97,;7.22,-44.21,;5.88,-45.01,;5.9,-46.55,;4.58,-47.33,;7.24,-47.3,;8.58,-46.52,;7.26,-48.85,;8.17,-50.09,;9.7,-50.09,;7.26,-51.34,;5.79,-50.86,;4.46,-51.64,;4.47,-53.18,;3.13,-50.87,;3.13,-49.33,;4.46,-48.56,;5.79,-49.32,;12.55,-44.16,)| Show InChI InChI=1S/C23H20Cl2N2O3S/c1-14(2)31(28,29)18-7-4-6-16(12-18)30-17-10-11-19(24)22(13-17)27-15(3)26-23-20(25)8-5-9-21(23)27/h4-14H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306079
(4-chloro-1-(2-chloro-5-(3-(methylsulfonyl)phenoxy)...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(C)(=O)=O)ccc1Cl |(26.98,-36.72,;25.44,-36.72,;24.53,-37.97,;23.07,-37.49,;21.74,-38.27,;21.74,-39.81,;20.4,-37.5,;20.41,-35.96,;21.73,-35.19,;23.07,-35.95,;24.53,-35.48,;24.52,-33.93,;25.85,-33.15,;25.84,-31.61,;27.16,-30.83,;28.5,-31.59,;28.51,-33.12,;29.85,-33.88,;31.17,-33.1,;31.16,-31.55,;29.82,-30.8,;32.48,-30.76,;33.8,-31.53,;33.56,-29.67,;31.38,-29.67,;24.49,-30.85,;23.16,-31.64,;23.18,-33.18,;21.86,-33.97,)| Show InChI InChI=1S/C21H16Cl2N2O3S/c1-13-24-21-18(23)7-4-8-19(21)25(13)20-12-15(9-10-17(20)22)28-14-5-3-6-16(11-14)29(2,26)27/h3-12H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306078
(1-(2-chloro-5-(3-(isopropylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H18ClF3N2O3S/c1-14(2)33(30,31)17-6-3-5-15(11-17)32-16-9-10-19(24)21(12-16)29-13-28-22-18(23(25,26)27)7-4-8-20(22)29/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306071
(2-cyclopropyl-1-(3-(3-(methylsulfonyl)phenoxy)phen...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C2CC2)c1 Show InChI InChI=1S/C24H19F3N2O3S/c1-33(30,31)19-8-3-7-18(14-19)32-17-6-2-5-16(13-17)29-21-10-4-9-20(24(25,26)27)22(21)28-23(29)15-11-12-15/h2-10,13-15H,11-12H2,1H3 | PDB
UniProtKB/SwissProt
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| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306082
(4-chloro-1-(2-chloro-5-(3-fluoro-5-(methylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cc(F)cc(c2)S(C)(=O)=O)ccc1Cl |(24.36,-49.54,;22.82,-49.54,;21.92,-50.79,;20.45,-50.31,;19.12,-51.09,;19.12,-52.63,;17.79,-50.32,;17.79,-48.78,;19.12,-48.01,;20.45,-48.77,;21.92,-48.29,;21.9,-46.75,;23.24,-45.97,;23.22,-44.42,;24.55,-43.64,;25.89,-44.4,;25.9,-45.93,;27.23,-46.69,;27.25,-48.23,;28.56,-45.91,;28.54,-44.36,;27.2,-43.61,;29.86,-43.58,;31.19,-44.35,;30.95,-42.48,;28.76,-42.48,;21.88,-43.66,;20.54,-44.46,;20.56,-46,;19.24,-46.78,)| Show InChI InChI=1S/C21H15Cl2FN2O3S/c1-12-25-21-18(23)4-3-5-19(21)26(12)20-11-14(6-7-17(20)22)29-15-8-13(24)9-16(10-15)30(2,27)28/h3-11H,1-2H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306073
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-2-phenyl-4...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)-c2ccccc2)c1 Show InChI InChI=1S/C27H19F3N2O3S/c1-36(33,34)22-13-6-12-21(17-22)35-20-11-5-10-19(16-20)32-24-15-7-14-23(27(28,29)30)25(24)31-26(32)18-8-3-2-4-9-18/h2-17H,1H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306059
(4-chloro-1-(3-(3-(ethylsulfonyl)phenoxy)phenyl)-2-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1 Show InChI InChI=1S/C22H19ClN2O3S/c1-3-29(26,27)19-10-5-9-18(14-19)28-17-8-4-7-16(13-17)25-15(2)24-22-20(23)11-6-12-21(22)25/h4-14H,3H2,1-2H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306068
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-2,4-bis(tr...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C(F)(F)F)c1 Show InChI InChI=1S/C22H14F6N2O3S/c1-34(31,32)16-8-3-7-15(12-16)33-14-6-2-5-13(11-14)30-18-10-4-9-17(21(23,24)25)19(18)29-20(30)22(26,27)28/h2-12H,1H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306060
(1-(3-(3-(isopropylsulfonyl)phenoxy)phenyl)-2-methy...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C24H21F3N2O3S/c1-15(2)33(30,31)20-10-5-9-19(14-20)32-18-8-4-7-17(13-18)29-16(3)28-23-21(24(25,26)27)11-6-12-22(23)29/h4-15H,1-3H3 | PDB
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| n/a | n/a | 5.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306061
(4-chloro-1-(3-(3-(isopropylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1 Show InChI InChI=1S/C23H21ClN2O3S/c1-15(2)30(27,28)20-10-5-9-19(14-20)29-18-8-4-7-17(13-18)26-16(3)25-23-21(24)11-6-12-22(23)26/h4-15H,1-3H3 | PDB
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| n/a | n/a | 5.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306058
(1-(3-(3-(ethylsulfonyl)phenoxy)phenyl)-2-methyl-4-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H19F3N2O3S/c1-3-32(29,30)19-10-5-9-18(14-19)31-17-8-4-7-16(13-17)28-15(2)27-22-20(23(24,25)26)11-6-12-21(22)28/h4-14H,3H2,1-2H3 | PDB
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| n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306028
(2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C22H17F3N2O3S/c1-14-26-21-19(22(23,24)25)10-5-11-20(21)27(14)15-6-3-7-16(12-15)30-17-8-4-9-18(13-17)31(2,28)29/h3-13H,1-2H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306056
(4-chloro-2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C21H17ClN2O3S/c1-14-23-21-19(22)10-5-11-20(21)24(14)15-6-3-7-16(12-15)27-17-8-4-9-18(13-17)28(2,25)26/h3-13H,1-2H3 | PDB
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PubMed
| n/a | n/a | 7.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM19993
(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 | PDB
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Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306080
(4-chloro-1-(2-chloro-5-(3-(ethylsulfonyl)phenoxy)p...)Show SMILES CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(3.48,-43.65,;2.14,-44.41,;.82,-43.64,;1.9,-42.55,;-.28,-42.55,;-.5,-44.43,;-.48,-45.97,;-1.81,-46.75,;-3.15,-46,;-3.15,-44.46,;-4.49,-43.71,;-5.82,-44.49,;-7.16,-43.73,;-8.5,-44.52,;-8.48,-46.06,;-9.8,-46.84,;-7.14,-46.81,;-5.8,-46.03,;-7.12,-48.35,;-6.22,-49.6,;-4.68,-49.6,;-7.12,-50.85,;-8.59,-50.37,;-9.92,-51.15,;-9.91,-52.69,;-11.26,-50.38,;-11.26,-48.84,;-9.92,-48.07,;-8.59,-48.83,;-1.84,-43.68,)| Show InChI InChI=1S/C22H18Cl2N2O3S/c1-3-30(27,28)17-7-4-6-15(12-17)29-16-10-11-18(23)21(13-16)26-14(2)25-22-19(24)8-5-9-20(22)26/h4-13H,3H2,1-2H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306063
(3-(3-(3-(2-methyl-4-(trifluoromethyl)-1H-benzo[d]i...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F Show InChI InChI=1S/C24H21F3N2O4S/c1-16-28-23-21(24(25,26)27)10-4-11-22(23)29(16)17-6-2-7-18(14-17)33-19-8-3-9-20(15-19)34(31,32)13-5-12-30/h2-4,6-11,14-15,30H,5,12-13H2,1H3 | PDB
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| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306065
(1-(3-(3-fluoro-5-(methylsulfonyl)phenoxy)phenyl)-2...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cc(F)cc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C22H16F4N2O3S/c1-13-27-21-19(22(24,25)26)7-4-8-20(21)28(13)15-5-3-6-16(11-15)31-17-9-14(23)10-18(12-17)32(2,29)30/h3-12H,1-2H3 | PDB
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| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM19993
(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 | PDB
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Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306079
(4-chloro-1-(2-chloro-5-(3-(methylsulfonyl)phenoxy)...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(C)(=O)=O)ccc1Cl |(26.98,-36.72,;25.44,-36.72,;24.53,-37.97,;23.07,-37.49,;21.74,-38.27,;21.74,-39.81,;20.4,-37.5,;20.41,-35.96,;21.73,-35.19,;23.07,-35.95,;24.53,-35.48,;24.52,-33.93,;25.85,-33.15,;25.84,-31.61,;27.16,-30.83,;28.5,-31.59,;28.51,-33.12,;29.85,-33.88,;31.17,-33.1,;31.16,-31.55,;29.82,-30.8,;32.48,-30.76,;33.8,-31.53,;33.56,-29.67,;31.38,-29.67,;24.49,-30.85,;23.16,-31.64,;23.18,-33.18,;21.86,-33.97,)| Show InChI InChI=1S/C21H16Cl2N2O3S/c1-13-24-21-18(23)7-4-8-19(21)25(13)20-12-15(9-10-17(20)22)28-14-5-3-6-16(11-14)29(2,26)27/h3-12H,1-2H3 | PDB
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| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306070
(2-isopropyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)c1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C24H21F3N2O3S/c1-15(2)23-28-22-20(24(25,26)27)11-6-12-21(22)29(23)16-7-4-8-17(13-16)32-18-9-5-10-19(14-18)33(3,30)31/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306083
(4-chloro-1-(2-chloro-5-(3-(trifluoromethylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)ccc1Cl |(40.06,-46.33,;38.52,-46.33,;37.61,-47.58,;36.15,-47.1,;34.82,-47.88,;34.82,-49.42,;33.48,-47.11,;33.49,-45.57,;34.81,-44.8,;36.15,-45.56,;37.61,-45.09,;37.6,-43.54,;38.93,-42.76,;38.92,-41.22,;40.25,-40.44,;41.58,-41.2,;41.59,-42.73,;42.93,-43.49,;44.26,-42.71,;44.24,-41.16,;42.9,-40.41,;45.56,-40.37,;46.64,-39.28,;44.46,-39.28,;46.88,-41.14,;48.22,-40.38,;46.88,-42.68,;48.37,-41.54,;37.57,-40.46,;36.24,-41.25,;36.26,-42.79,;34.94,-43.58,)| Show InChI InChI=1S/C21H13Cl2F3N2O3S/c1-12-27-20-17(23)6-3-7-18(20)28(12)19-11-14(8-9-16(19)22)31-13-4-2-5-15(10-13)32(29,30)21(24,25)26/h2-11H,1H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306064
(4-chloro-2-methyl-1-(3-(3-(trifluoromethylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)c1 Show InChI InChI=1S/C21H14ClF3N2O3S/c1-13-26-20-18(22)9-4-10-19(20)27(13)14-5-2-6-15(11-14)30-16-7-3-8-17(12-16)31(28,29)21(23,24)25/h2-12H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306069
(2-ethyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4-...)Show SMILES CCc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C23H19F3N2O3S/c1-3-21-27-22-19(23(24,25)26)11-6-12-20(22)28(21)15-7-4-8-16(13-15)31-17-9-5-10-18(14-17)32(2,29)30/h4-14H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306062
(2-methyl-1-(3-(3-(propylsulfonyl)phenoxy)phenyl)-4...)Show SMILES CCCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C24H21F3N2O3S/c1-3-13-33(30,31)20-10-5-9-19(15-20)32-18-8-4-7-17(14-18)29-16(2)28-23-21(24(25,26)27)11-6-12-22(23)29/h4-12,14-15H,3,13H2,1-2H3 | PDB
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| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306075
(4-chloro-2-isopropyl-1-(3-(3-(methylsulfonyl)pheno...)Show SMILES CC(C)c1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C23H21ClN2O3S/c1-15(2)23-25-22-20(24)11-6-12-21(22)26(23)16-7-4-8-17(13-16)29-18-9-5-10-19(14-18)30(3,27)28/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306076
(1-(2-chloro-5-(3-(methylsulfonyl)phenoxy)phenyl)-4...)Show SMILES CS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C21H14ClF3N2O3S/c1-31(28,29)15-5-2-4-13(10-15)30-14-8-9-17(22)19(11-14)27-12-26-20-16(21(23,24)25)6-3-7-18(20)27/h2-12H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306077
(1-(2-chloro-5-(3-(ethylsulfonyl)phenoxy)phenyl)-4-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C22H16ClF3N2O3S/c1-2-32(29,30)16-6-3-5-14(11-16)31-15-9-10-18(23)20(12-15)28-13-27-21-17(22(24,25)26)7-4-8-19(21)28/h3-13H,2H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306081
(4-chloro-1-(2-chloro-5-(3-(isopropylsulfonyl)pheno...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(17.87,-44.13,;16.53,-44.9,;16.53,-46.44,;15.21,-44.13,;16.29,-43.03,;14.11,-43.03,;13.89,-44.92,;13.91,-46.46,;12.58,-47.24,;11.24,-46.49,;11.23,-44.95,;9.89,-44.19,;8.57,-44.97,;7.22,-44.21,;5.88,-45.01,;5.9,-46.55,;4.58,-47.33,;7.24,-47.3,;8.58,-46.52,;7.26,-48.85,;8.17,-50.09,;9.7,-50.09,;7.26,-51.34,;5.79,-50.86,;4.46,-51.64,;4.47,-53.18,;3.13,-50.87,;3.13,-49.33,;4.46,-48.56,;5.79,-49.32,;12.55,-44.16,)| Show InChI InChI=1S/C23H20Cl2N2O3S/c1-14(2)31(28,29)18-7-4-6-16(12-18)30-17-10-11-19(24)22(13-17)27-15(3)26-23-20(25)8-5-9-21(23)27/h4-14H,1-3H3 | PDB
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| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306066
(1-(3-(3-(ethylsulfonyl)-5-fluorophenoxy)phenyl)-2-...)Show SMILES CCS(=O)(=O)c1cc(F)cc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H18F4N2O3S/c1-3-33(30,31)19-11-15(24)10-18(13-19)32-17-7-4-6-16(12-17)29-14(2)28-22-20(23(25,26)27)8-5-9-21(22)29/h4-13H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
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| Article
PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306082
(4-chloro-1-(2-chloro-5-(3-fluoro-5-(methylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cc(F)cc(c2)S(C)(=O)=O)ccc1Cl |(24.36,-49.54,;22.82,-49.54,;21.92,-50.79,;20.45,-50.31,;19.12,-51.09,;19.12,-52.63,;17.79,-50.32,;17.79,-48.78,;19.12,-48.01,;20.45,-48.77,;21.92,-48.29,;21.9,-46.75,;23.24,-45.97,;23.22,-44.42,;24.55,-43.64,;25.89,-44.4,;25.9,-45.93,;27.23,-46.69,;27.25,-48.23,;28.56,-45.91,;28.54,-44.36,;27.2,-43.61,;29.86,-43.58,;31.19,-44.35,;30.95,-42.48,;28.76,-42.48,;21.88,-43.66,;20.54,-44.46,;20.56,-46,;19.24,-46.78,)| Show InChI InChI=1S/C21H15Cl2FN2O3S/c1-12-25-21-18(23)4-3-5-19(21)26(12)20-11-14(6-7-17(20)22)29-15-8-13(24)9-16(10-15)30(2,27)28/h3-11H,1-2H3 | PDB
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Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306067
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4-(trifluo...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C21H15F3N2O3S/c1-30(27,28)17-8-3-7-16(12-17)29-15-6-2-5-14(11-15)26-13-25-20-18(21(22,23)24)9-4-10-19(20)26/h2-13H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
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| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306078
(1-(2-chloro-5-(3-(isopropylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H18ClF3N2O3S/c1-14(2)33(30,31)17-6-3-5-15(11-17)32-16-9-10-19(24)21(12-16)29-13-28-22-18(23(25,26)27)7-4-8-20(22)29/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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| CHEMBL
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PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306083
(4-chloro-1-(2-chloro-5-(3-(trifluoromethylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)ccc1Cl |(40.06,-46.33,;38.52,-46.33,;37.61,-47.58,;36.15,-47.1,;34.82,-47.88,;34.82,-49.42,;33.48,-47.11,;33.49,-45.57,;34.81,-44.8,;36.15,-45.56,;37.61,-45.09,;37.6,-43.54,;38.93,-42.76,;38.92,-41.22,;40.25,-40.44,;41.58,-41.2,;41.59,-42.73,;42.93,-43.49,;44.26,-42.71,;44.24,-41.16,;42.9,-40.41,;45.56,-40.37,;46.64,-39.28,;44.46,-39.28,;46.88,-41.14,;48.22,-40.38,;46.88,-42.68,;48.37,-41.54,;37.57,-40.46,;36.24,-41.25,;36.26,-42.79,;34.94,-43.58,)| Show InChI InChI=1S/C21H13Cl2F3N2O3S/c1-12-27-20-17(23)6-3-7-18(20)28(12)19-11-14(8-9-16(19)22)31-13-4-2-5-15(10-13)32(29,30)21(24,25)26/h2-11H,1H3 | PDB
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GoogleScholar
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| n/a | n/a | 85 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306071
(2-cyclopropyl-1-(3-(3-(methylsulfonyl)phenoxy)phen...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C2CC2)c1 Show InChI InChI=1S/C24H19F3N2O3S/c1-33(30,31)19-8-3-7-18(14-19)32-17-6-2-5-16(13-17)29-21-10-4-9-20(24(25,26)27)22(21)28-23(29)15-11-12-15/h2-10,13-15H,11-12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 93 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306059
(4-chloro-1-(3-(3-(ethylsulfonyl)phenoxy)phenyl)-2-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1 Show InChI InChI=1S/C22H19ClN2O3S/c1-3-29(26,27)19-10-5-9-18(14-19)28-17-8-4-7-16(13-17)25-15(2)24-22-20(23)11-6-12-21(22)25/h4-14H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306056
(4-chloro-2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C21H17ClN2O3S/c1-14-23-21-19(22)10-5-11-20(21)24(14)15-6-3-7-16(12-15)27-17-8-4-9-18(13-17)28(2,25)26/h3-13H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306028
(2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C22H17F3N2O3S/c1-14-26-21-19(22(23,24)25)10-5-11-20(21)27(14)15-6-3-7-16(12-15)30-17-8-4-9-18(13-17)31(2,28)29/h3-13H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 111 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306058
(1-(3-(3-(ethylsulfonyl)phenoxy)phenyl)-2-methyl-4-...)Show SMILES CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H19F3N2O3S/c1-3-32(29,30)19-10-5-9-18(14-19)31-17-8-4-7-16(13-17)28-15(2)27-22-20(23(24,25)26)11-6-12-21(22)28/h4-14H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 128 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306061
(4-chloro-1-(3-(3-(isopropylsulfonyl)phenoxy)phenyl...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1 Show InChI InChI=1S/C23H21ClN2O3S/c1-15(2)30(27,28)20-10-5-9-19(14-20)29-18-8-4-7-17(13-18)26-16(3)25-23-21(24)11-6-12-22(23)26/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 138 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306064
(4-chloro-2-methyl-1-(3-(3-(trifluoromethylsulfonyl...)Show SMILES Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)c1 Show InChI InChI=1S/C21H14ClF3N2O3S/c1-13-26-20-18(22)9-4-10-19(20)27(13)14-5-2-6-15(11-14)30-16-7-3-8-17(12-16)31(28,29)21(23,24)25/h2-12H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 183 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306060
(1-(3-(3-(isopropylsulfonyl)phenoxy)phenyl)-2-methy...)Show SMILES CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C24H21F3N2O3S/c1-15(2)33(30,31)20-10-5-9-19(14-20)32-18-8-4-7-17(13-18)29-16(3)28-23-21(24(25,26)27)11-6-12-22(23)29/h4-15H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 248 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-alpha
(Homo sapiens (Human)) | BDBM50306057
(2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-1...)Show SMILES Cc1nc2ccccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C21H18N2O3S/c1-15-22-20-11-3-4-12-21(20)23(15)16-7-5-8-17(13-16)26-18-9-6-10-19(14-18)27(2,24)25/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 269 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306065
(1-(3-(3-fluoro-5-(methylsulfonyl)phenoxy)phenyl)-2...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cc(F)cc(c2)S(C)(=O)=O)c1)C(F)(F)F Show InChI InChI=1S/C22H16F4N2O3S/c1-13-27-21-19(22(24,25)26)7-4-8-20(21)28(13)15-5-3-6-16(11-15)31-17-9-14(23)10-18(12-17)32(2,29)30/h3-12H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 315 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306063
(3-(3-(3-(2-methyl-4-(trifluoromethyl)-1H-benzo[d]i...)Show SMILES Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F Show InChI InChI=1S/C24H21F3N2O4S/c1-16-28-23-21(24(25,26)27)10-4-11-22(23)29(16)17-6-2-7-18(14-17)33-19-8-3-9-20(15-19)34(31,32)13-5-12-30/h2-4,6-11,14-15,30H,5,12-13H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
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PubMed
| n/a | n/a | 436 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306062
(2-methyl-1-(3-(3-(propylsulfonyl)phenoxy)phenyl)-4...)Show SMILES CCCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C24H21F3N2O3S/c1-3-13-33(30,31)20-10-5-9-19(15-20)32-18-8-4-7-17(14-18)29-16(2)28-23-21(24(25,26)27)11-6-12-22(23)29/h4-12,14-15H,3,13H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
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UniChem
Patents
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| Article
PubMed
| n/a | n/a | 462 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306066
(1-(3-(3-(ethylsulfonyl)-5-fluorophenoxy)phenyl)-2-...)Show SMILES CCS(=O)(=O)c1cc(F)cc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C23H18F4N2O3S/c1-3-33(30,31)19-11-15(24)10-18(13-19)32-17-7-4-6-16(12-17)29-14(2)28-22-20(23(25,26)27)8-5-9-21(22)29/h4-13H,3H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 489 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306067
(1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-4-(trifluo...)Show SMILES CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2cnc3c(cccc23)C(F)(F)F)c1 Show InChI InChI=1S/C21H15F3N2O3S/c1-30(27,28)17-8-3-7-16(12-17)29-15-6-2-5-14(11-15)26-13-25-20-18(21(22,23)24)9-4-10-19(20)26/h2-13H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 882 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
Oxysterols receptor LXR-beta
(Homo sapiens (Human)) | BDBM50306057
(2-methyl-1-(3-(3-(methylsulfonyl)phenoxy)phenyl)-1...)Show SMILES Cc1nc2ccccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1 Show InChI InChI=1S/C21H18N2O3S/c1-15-22-20-11-3-4-12-21(20)23(15)16-7-5-8-17(13-16)26-18-9-6-10-19(14-18)27(2,24)25/h3-14H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD |
Bioorg Med Chem Lett 20: 526-30 (2010)
Article DOI: 10.1016/j.bmcl.2009.11.099
BindingDB Entry DOI: 10.7270/Q2HT2PDZ |
More data for this
Ligand-Target Pair | |
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