Compile Data Set for Download or QSAR
Found 33 Enz. Inhib. hit(s) with all data for entry = 3048
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27251(indan derivative, 1 | tert-butyl 2-(2-benzenesulfo...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H28N2O4S/c1-28(2,3)34-27(31)30-25-12-8-7-9-20(25)18-26(30)21-14-13-19-16-23(17-22(19)15-21)29-35(32,33)24-10-5-4-6-11-24/h4-15,18,23,29H,16-17H2,1-3H3
Affinity DataEC50:  190nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM19993(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
Affinity DataEC50:  15nMAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27253(Boc-indole derivative, 11 | tert-butyl 2-[4-(2-ben...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C27H28N2O4S/c1-27(2,3)33-26(30)29-24-12-8-7-9-22(24)19-25(29)21-15-13-20(14-16-21)17-18-28-34(31,32)23-10-5-4-6-11-23/h4-16,19,28H,17-18H2,1-3H3
Affinity DataEC50:  120nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27254(Boc-indole derivative, 12 | tert-butyl 2-[4-(benze...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CNS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C26H26N2O4S/c1-26(2,3)32-25(29)28-23-12-8-7-9-21(23)17-24(28)20-15-13-19(14-16-20)18-27-33(30,31)22-10-5-4-6-11-22/h4-17,27H,18H2,1-3H3
Affinity DataEC50:  220nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27255(Boc-indole derivative, 13 | tert-butyl 2-[4-(3-ben...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCNS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C28H30N2O4S/c1-28(2,3)34-27(31)30-25-14-8-7-11-23(25)20-26(30)22-17-15-21(16-18-22)10-9-19-29-35(32,33)24-12-5-4-6-13-24/h4-8,11-18,20,29H,9-10,19H2,1-3H3
Affinity DataEC50:  350nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27256(Boc-indole derivative, 14 | tert-butyl 2-(4-benzen...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(NS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C25H24N2O4S/c1-25(2,3)31-24(28)27-22-12-8-7-9-19(22)17-23(27)18-13-15-20(16-14-18)26-32(29,30)21-10-5-4-6-11-21/h4-17,26H,1-3H3
Affinity DataEC50:  1.32E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27257(Boc-indole derivative, 15 | tert-butyl 2-{4-[2-(th...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2cccs2)cc1
Show InChI InChI=1S/C25H26N2O4S2/c1-25(2,3)31-24(28)27-21-8-5-4-7-20(21)17-22(27)19-12-10-18(11-13-19)14-15-26-33(29,30)23-9-6-16-32-23/h4-13,16-17,26H,14-15H2,1-3H3
Affinity DataEC50:  58nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27258(Boc-indole derivative, 16 | tert-butyl 2-[4-(2-{[5...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2ccc(s2)-c2ccccn2)cc1
Show InChI InChI=1S/C30H29N3O4S2/c1-30(2,3)37-29(34)33-25-10-5-4-8-23(25)20-26(33)22-13-11-21(12-14-22)17-19-32-39(35,36)28-16-15-27(38-28)24-9-6-7-18-31-24/h4-16,18,20,32H,17,19H2,1-3H3
Affinity DataEC50:  230nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27259(Boc-indole derivative, 17 | tert-butyl 2-{4-[(phen...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C27H26N2O3/c1-27(2,3)32-26(31)29-23-12-8-7-11-22(23)17-24(29)20-15-13-19(14-16-20)18-28-25(30)21-9-5-4-6-10-21/h4-17H,18H2,1-3H3,(H,28,30)
Affinity DataEC50:  1.80E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27260(Boc-indole derivative, 18 | tert-butyl 2-{4-[2-(ph...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C28H28N2O3/c1-28(2,3)33-27(32)30-24-12-8-7-11-23(24)19-25(30)21-15-13-20(14-16-21)17-18-29-26(31)22-9-5-4-6-10-22/h4-16,19H,17-18H2,1-3H3,(H,29,31)
Affinity DataEC50:  1.75E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27261(Boc-indole derivative, 19 | tert-butyl 2-{4-[3-(ph...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C29H30N2O3/c1-29(2,3)34-28(33)31-25-14-8-7-13-24(25)20-26(31)22-17-15-21(16-18-22)10-9-19-30-27(32)23-11-5-4-6-12-23/h4-8,11-18,20H,9-10,19H2,1-3H3,(H,30,32)
Affinity DataEC50:  360nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27262(Boc-indole derivative, 20 | tert-butyl 2-[4-(amino...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CN)cc1
Show InChI InChI=1S/C20H22N2O2/c1-20(2,3)24-19(23)22-17-7-5-4-6-16(17)12-18(22)15-10-8-14(13-21)9-11-15/h4-12H,13,21H2,1-3H3
Affinity DataEC50:  5.60E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27263(Boc-indole derivative, 21 | tert-butyl 2-[4-(cyano...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CC#N)cc1
Show InChI InChI=1S/C21H20N2O2/c1-21(2,3)25-20(24)23-18-7-5-4-6-17(18)14-19(23)16-10-8-15(9-11-16)12-13-22/h4-11,14H,12H2,1-3H3
Affinity DataEC50:  300nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27264(Boc-indole derivative, 22 | tert-butyl 2-[4-(2-cya...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
Show InChI InChI=1S/C22H22N2O2/c1-22(2,3)26-21(25)24-19-9-5-4-8-18(19)15-20(24)17-12-10-16(11-13-17)7-6-14-23/h4-5,8-13,15H,6-7H2,1-3H3
Affinity DataEC50:  130nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27265(Boc-indole derivative, 23 | tert-butyl 2-[4-(3-hyd...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCO)cc1
Show InChI InChI=1S/C22H25NO3/c1-22(2,3)26-21(25)23-19-9-5-4-8-18(19)15-20(23)17-12-10-16(11-13-17)7-6-14-24/h4-5,8-13,15,24H,6-7,14H2,1-3H3
Affinity DataEC50:  380nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27266(Boc-indole derivative, 24 | tert-butyl 2-[4-(2-hyd...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(OCCO)cc1
Show InChI InChI=1S/C21H23NO4/c1-21(2,3)26-20(24)22-18-7-5-4-6-16(18)14-19(22)15-8-10-17(11-9-15)25-13-12-23/h4-11,14,23H,12-13H2,1-3H3
Affinity DataEC50:  420nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27267(3-(4-{1-[(tert-butoxy)carbonyl]-1H-indol-2-yl}phen...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C22H23NO4/c1-22(2,3)27-21(26)23-18-7-5-4-6-17(18)14-19(23)16-11-8-15(9-12-16)10-13-20(24)25/h4-9,11-12,14H,10,13H2,1-3H3,(H,24,25)
Affinity DataEC50:  220nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27268(Boc-indole derivative, 26 | tert-butyl 2-[4-(2-car...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(N)=O)cc1
Show InChI InChI=1S/C22H24N2O3/c1-22(2,3)27-21(26)24-18-7-5-4-6-17(18)14-19(24)16-11-8-15(9-12-16)10-13-20(23)25/h4-9,11-12,14H,10,13H2,1-3H3,(H2,23,25)
Affinity DataEC50:  57nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27269(Boc-indole derivative, 27 | tert-butyl 2-{4-[(1E)-...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(\C=C\C(N)=O)cc1
Show InChI InChI=1S/C22H22N2O3/c1-22(2,3)27-21(26)24-18-7-5-4-6-17(18)14-19(24)16-11-8-15(9-12-16)10-13-20(23)25/h4-14H,1-3H3,(H2,23,25)/b13-10+
Affinity DataEC50:  4.90E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27270(Boc-indole derivative, 28 | tert-butyl 2-{4-[2-(me...)
Show SMILES CNC(=O)CCc1ccc(cc1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C23H26N2O3/c1-23(2,3)28-22(27)25-19-8-6-5-7-18(19)15-20(25)17-12-9-16(10-13-17)11-14-21(26)24-4/h5-10,12-13,15H,11,14H2,1-4H3,(H,24,26)
Affinity DataEC50:  490nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27271(Boc-indole derivative, 29 | tert-butyl 2-(4-{2-[(2...)
Show SMILES CC(C)CNC(=O)CCc1ccc(cc1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C26H32N2O3/c1-18(2)17-27-24(29)15-12-19-10-13-20(14-11-19)23-16-21-8-6-7-9-22(21)28(23)25(30)31-26(3,4)5/h6-11,13-14,16,18H,12,15,17H2,1-5H3,(H,27,29)
Affinity DataEC50:  1.51E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27272(Boc-indole derivative, 30 | tert-butyl 2-{4-[2-(ph...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C28H28N2O3/c1-28(2,3)33-27(32)30-24-12-8-7-9-22(24)19-25(30)21-16-13-20(14-17-21)15-18-26(31)29-23-10-5-4-6-11-23/h4-14,16-17,19H,15,18H2,1-3H3,(H,29,31)
Affinity DataEC50:  1.78E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27273(3-[4-(1-benzoyl-1H-indol-2-yl)phenyl]propanenitril...)
Show SMILES O=C(c1ccccc1)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
Show InChI InChI=1S/C24H18N2O/c25-16-6-7-18-12-14-19(15-13-18)23-17-21-10-4-5-11-22(21)26(23)24(27)20-8-2-1-3-9-20/h1-5,8-15,17H,6-7H2
Affinity DataEC50:  12nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27274(N-{2-[4-(1-benzoyl-1H-indol-2-yl)phenyl]ethyl}benz...)
Show SMILES O=C(NCCc1ccc(cc1)-c1cc2ccccc2n1C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C30H24N2O2/c33-29(24-9-3-1-4-10-24)31-20-19-22-15-17-23(18-16-22)28-21-26-13-7-8-14-27(26)32(28)30(34)25-11-5-2-6-12-25/h1-18,21H,19-20H2,(H,31,33)
Affinity DataEC50:  1.78E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27251(indan derivative, 1 | tert-butyl 2-(2-benzenesulfo...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H28N2O4S/c1-28(2,3)34-27(31)30-25-12-8-7-9-20(25)18-26(30)21-14-13-19-16-23(17-22(19)15-21)29-35(32,33)24-10-5-4-6-11-24/h4-15,18,23,29H,16-17H2,1-3H3
Affinity DataEC50:  1.50E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27264(Boc-indole derivative, 22 | tert-butyl 2-[4-(2-cya...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
Show InChI InChI=1S/C22H22N2O2/c1-22(2,3)26-21(25)24-19-9-5-4-8-18(19)15-20(24)17-12-10-16(11-13-17)7-6-14-23/h4-5,8-13,15H,6-7H2,1-3H3
Affinity DataEC50:  1.19E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27267(3-(4-{1-[(tert-butoxy)carbonyl]-1H-indol-2-yl}phen...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C22H23NO4/c1-22(2,3)27-21(26)23-18-7-5-4-6-17(18)14-19(23)16-11-8-15(9-12-16)10-13-20(24)25/h4-9,11-12,14H,10,13H2,1-3H3,(H,24,25)
Affinity DataEC50:  1.15E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27268(Boc-indole derivative, 26 | tert-butyl 2-[4-(2-car...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(N)=O)cc1
Show InChI InChI=1S/C22H24N2O3/c1-22(2,3)27-21(26)24-18-7-5-4-6-17(18)14-19(24)16-11-8-15(9-12-16)10-13-20(23)25/h4-9,11-12,14H,10,13H2,1-3H3,(H2,23,25)
Affinity DataEC50:  1.11E+3nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27273(3-[4-(1-benzoyl-1H-indol-2-yl)phenyl]propanenitril...)
Show SMILES O=C(c1ccccc1)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
Show InChI InChI=1S/C24H18N2O/c25-16-6-7-18-12-14-19(15-13-18)23-17-21-10-4-5-11-22(21)26(23)24(27)20-8-2-1-3-9-20/h1-5,8-15,17H,6-7H2
Affinity DataEC50:  220nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM19992(2-[3-[3-[[2-chloro-3-(trifluoromethyl)phenyl]methy...)
Show SMILES OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
Show InChI InChI=1S/C33H31ClF3NO3/c34-32-27(15-8-17-30(32)33(35,36)37)22-38(18-9-19-41-28-16-7-10-24(20-28)21-31(39)40)23-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-8,10-17,20,29H,9,18-19,21-23H2,(H,39,40)
Affinity DataEC50:  367nMAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-alpha(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM19993(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
Affinity DataEC50:  40nMAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM19992(2-[3-[3-[[2-chloro-3-(trifluoromethyl)phenyl]methy...)
Show SMILES OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
Show InChI InChI=1S/C33H31ClF3NO3/c34-32-27(15-8-17-30(32)33(35,36)37)22-38(18-9-19-41-28-16-7-10-24(20-28)21-31(39)40)23-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-8,10-17,20,29H,9,18-19,21-23H2,(H,39,40)
Affinity DataEC50:  35nMAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Tanabe Research Laboratories USA, Inc.

LigandPNGBDBM27252(Boc-indole derivative, 10 | tert-butyl 2-[3-(2-ben...)
Show SMILES CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1cccc(CCNS(=O)(=O)c2ccccc2)c1
Show InChI InChI=1S/C27H28N2O4S/c1-27(2,3)33-26(30)29-24-15-8-7-11-22(24)19-25(29)21-12-9-10-20(18-21)16-17-28-34(31,32)23-13-5-4-6-14-23/h4-15,18-19,28H,16-17H2,1-3H3
Affinity DataEC50:  420nMpH: 7.5 T: 2°CAssay Description:Polyhistidine-tagged human LXR ligand-binding domain was mixed with the test compound, biotin-SRC1 peptide, streptavidin-allophycocyanin, and europiu...More data for this Ligand-Target Pair