Compile Data Set for Download or QSAR
Found 27 Enz. Inhib. hit(s) with all data for assayid = 5 entry = 50030346
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM20000(2-(4-{3-[3-benzyl-8-(trifluoromethyl)quinolin-4-yl...)
Show SMILES OC(=O)Cc1ccc(COc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)cc1
Show InChI InChI=1S/C32H24F3NO3/c33-32(34,35)28-11-5-10-27-30(25(19-36-31(27)28)16-21-6-2-1-3-7-21)24-8-4-9-26(18-24)39-20-23-14-12-22(13-15-23)17-29(37)38/h1-15,18-19H,16-17,20H2,(H,37,38)
Affinity DataIC50: 2.00E+3nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50227159(2-(4-(3-(3-benzyl-8-(trifluoromethyl)quinolin-4-yl...)
Show SMILES Cc1c(C)c(NCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)ccc1CC(O)=O
Show InChI InChI=1S/C34H29F3N2O2/c1-21-22(2)30(15-14-25(21)18-31(40)41)38-19-24-10-6-11-26(17-24)32-27(16-23-8-4-3-5-9-23)20-39-33-28(32)12-7-13-29(33)34(35,36)37/h3-15,17,20,38H,16,18-19H2,1-2H3,(H,40,41)
Affinity DataIC50: 4.00E+3nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
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 DataIC50: 9.00E+3nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294735(CHEMBL558495 | [3-(8-Chloro-3-phenylcinnolin-4-yl)...)
Show SMILES Cn1ccc2cccc(CNc3cccc(c3)-c3c(nnc4c(Cl)cccc34)-c3ccccc3)c12
Show InChI InChI=1S/C30H23ClN4/c1-35-17-16-21-10-5-12-23(30(21)35)19-32-24-13-6-11-22(18-24)27-25-14-7-15-26(31)29(25)34-33-28(27)20-8-3-2-4-9-20/h2-18,32H,19H2,1H3
Affinity DataIC50: 1.00E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294747(3-Benzyl-8-chloro-4-(3-{[3-(trifluoromethyl)benzyl...)
Show SMILES FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1
Show InChI InChI=1S/C29H20ClF3N2O/c30-25-14-6-13-24-27(26(34-35-28(24)25)16-19-7-2-1-3-8-19)21-10-5-12-23(17-21)36-18-20-9-4-11-22(15-20)29(31,32)33/h1-15,17H,16,18H2
Affinity DataIC50: 1.00E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294748(3-Benzyl-8-chloro-4-(3-{[2-chloro-5-(trifluorometh...)
Show SMILES FC(F)(F)c1ccc(Cl)c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1
Show InChI InChI=1S/C29H19Cl2F3N2O/c30-24-13-12-21(29(32,33)34)15-20(24)17-37-22-9-4-8-19(16-22)27-23-10-5-11-25(31)28(23)36-35-26(27)14-18-6-2-1-3-7-18/h1-13,15-16H,14,17H2
Affinity DataIC50: 1.20E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294740(3-Benzyl-4-{3-[(1-methyl-1H-indol-7-yl)methoxy]-ph...)
Show SMILES Cn1ccc2cccc(COc3cccc(c3)-c3c(Cc4ccccc4)nnc4c(cccc34)C(F)(F)F)c12
Show InChI InChI=1S/C32H24F3N3O/c1-38-17-16-22-10-5-12-24(31(22)38)20-39-25-13-6-11-23(19-25)29-26-14-7-15-27(32(33,34)35)30(26)37-36-28(29)18-21-8-3-2-4-9-21/h2-17,19H,18,20H2,1H3
Affinity DataIC50: 1.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294746(3-Benzyl-8-chloro-4-{3-[(2-chlorobenzyl)oxy]phenyl...)
Show SMILES Clc1ccccc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(Cl)cccc12
Show InChI InChI=1S/C28H20Cl2N2O/c29-24-14-5-4-10-21(24)18-33-22-12-6-11-20(17-22)27-23-13-7-15-25(30)28(23)32-31-26(27)16-19-8-2-1-3-9-19/h1-15,17H,16,18H2
Affinity DataIC50: 1.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294753(CHEMBL552518 | [3-(8-Chloro-3-phenylcinnolin-4-yl)...)
Show SMILES FC(F)(F)c1cccc(CNc2cccc(c2)-c2c(nnc3c(Cl)cccc23)-c2ccccc2)c1Cl
Show InChI InChI=1S/C28H18Cl2F3N3/c29-23-14-6-12-21-24(26(35-36-27(21)23)17-7-2-1-3-8-17)18-9-4-11-20(15-18)34-16-19-10-5-13-22(25(19)30)28(31,32)33/h1-15,34H,16H2
Affinity DataIC50: 1.90E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294737(3-Benzyl-4-{3-[(1-methyl-1H-indol-7-yl)methoxy]-ph...)
Show SMILES Cn1ccc2cccc(COc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)c12
Show InChI InChI=1S/C33H25F3N2O/c1-38-17-16-23-10-5-12-25(32(23)38)21-39-27-13-6-11-24(19-27)30-26(18-22-8-3-2-4-9-22)20-37-31-28(30)14-7-15-29(31)33(34,35)36/h2-17,19-20H,18,21H2,1H3
Affinity DataIC50: 2.00E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294733(CHEMBL558494 | N-[3-(3-Benzyl-8-chlorocinnolin-4-y...)
Show SMILES Cn1ccc2cccc(CNc3cccc(c3)-c3c(Cc4ccccc4)nnc4c(Cl)cccc34)c12
Show InChI InChI=1S/C31H25ClN4/c1-36-17-16-22-10-5-12-24(31(22)36)20-33-25-13-6-11-23(19-25)29-26-14-7-15-27(32)30(26)35-34-28(29)18-21-8-3-2-4-9-21/h2-17,19,33H,18,20H2,1H3
Affinity DataIC50: 2.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294734(3-(3-Benzyl-8-chlorocinnolin-4-yl)phenyl][(1-methy...)
Show SMILES Cn1c(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)cc2ccccc12
Show InChI InChI=1S/C31H25ClN4/c1-36-25(19-22-11-5-6-16-29(22)36)20-33-24-13-7-12-23(18-24)30-26-14-8-15-27(32)31(26)35-34-28(30)17-21-9-3-2-4-10-21/h2-16,18-19,33H,17,20H2,1H3
Affinity DataIC50: 2.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294744(3-Benzyl-8-chloro-4-(3-{[2-chloro-3-(trifluorometh...)
Show SMILES FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1Cl
Show InChI InChI=1S/C29H19Cl2F3N2O/c30-24-14-6-12-22-26(25(35-36-28(22)24)15-18-7-2-1-3-8-18)19-9-4-11-21(16-19)37-17-20-10-5-13-23(27(20)31)29(32,33)34/h1-14,16H,15,17H2
Affinity DataIC50: 2.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294736(CHEMBL558496 | {3-[3-Benzyl-8-(trifluoromethyl)qui...)
Show SMILES Cn1ccc2cccc(CNc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)c12
Show InChI InChI=1S/C33H26F3N3/c1-39-17-16-23-10-5-12-25(32(23)39)20-37-27-13-6-11-24(19-27)30-26(18-22-8-3-2-4-9-22)21-38-31-28(30)14-7-15-29(31)33(34,35)36/h2-17,19,21,37H,18,20H2,1H3
Affinity DataIC50: 3.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294739(CHEMBL549892 | {3-[3-Benzyl-8-(trifluoromethyl)qui...)
Show SMILES FC(F)(F)c1cccc2c(c(Cc3ccccc3)cnc12)-c1cccc(NCc2cccc3cc[nH]c23)c1
Show InChI InChI=1S/C32H24F3N3/c33-32(34,35)28-14-6-13-27-29(25(20-38-31(27)28)17-21-7-2-1-3-8-21)23-10-5-12-26(18-23)37-19-24-11-4-9-22-15-16-36-30(22)24/h1-16,18,20,36-37H,17,19H2
Affinity DataIC50: 3.80E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294742(3-Benzyl-4-(3-{[5-fluoro-2-(trifluoromethyl)benzyl...)
Show SMILES Fc1ccc(c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)c1)C(F)(F)F
Show InChI InChI=1S/C30H19F7N2O/c31-21-12-13-24(29(32,33)34)20(15-21)17-40-22-9-4-8-19(16-22)27-23-10-5-11-25(30(35,36)37)28(23)39-38-26(27)14-18-6-2-1-3-7-18/h1-13,15-16H,14,17H2
Affinity DataIC50: 3.80E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294738(CHEMBL551981 | {3-[3-Benzyl-8-(trifluoromethyl)qui...)
Show SMILES Cn1c(CNc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)cc2ccccc12
Show InChI InChI=1S/C33H26F3N3/c1-39-27(19-23-11-5-6-16-30(23)39)21-37-26-13-7-12-24(18-26)31-25(17-22-9-3-2-4-10-22)20-38-32-28(31)14-8-15-29(32)33(34,35)36/h2-16,18-20,37H,17,21H2,1H3
Affinity DataIC50: 3.90E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294743(CHEMBL550035 | [3-(3-Benzyl-8-chlorocinnolin-4-yl)...)
Show SMILES FC(F)(F)c1cccc(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1Cl
Show InChI InChI=1S/C29H20Cl2F3N3/c30-24-14-6-12-22-26(25(36-37-28(22)24)15-18-7-2-1-3-8-18)19-9-4-11-21(16-19)35-17-20-10-5-13-23(27(20)31)29(32,33)34/h1-14,16,35H,15,17H2
Affinity DataIC50: 4.00E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294756(3-Benzyl-4-{3-[(1-methyl-1H-indol-2-yl)methoxy]-ph...)
Show SMILES Cn1c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)cc2ccccc12
Show InChI InChI=1S/C32H24F3N3O/c1-38-24(18-22-11-5-6-16-29(22)38)20-39-25-13-7-12-23(19-25)30-26-14-8-15-27(32(33,34)35)31(26)37-36-28(30)17-21-9-3-2-4-10-21/h2-16,18-19H,17,20H2,1H3
Affinity DataIC50: 4.20E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294741(3-Benzyl-4-(3-{[2-chloro-3-(trifluoromethyl)benzyl...)
Show SMILES FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)c1Cl
Show InChI InChI=1S/C30H19ClF6N2O/c31-27-20(10-5-13-23(27)29(32,33)34)17-40-21-11-4-9-19(16-21)26-22-12-6-14-24(30(35,36)37)28(22)39-38-25(26)15-18-7-2-1-3-8-18/h1-14,16H,15,17H2
Affinity DataIC50: 4.30E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294750(3-Benzyl-8-chloro-4-(3-{[5-fluoro-2-(trifluorometh...)
Show SMILES Fc1ccc(c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1)C(F)(F)F
Show InChI InChI=1S/C29H19ClF4N2O/c30-25-11-5-10-23-27(26(35-36-28(23)25)14-18-6-2-1-3-7-18)19-8-4-9-22(16-19)37-17-20-15-21(31)12-13-24(20)29(32,33)34/h1-13,15-16H,14,17H2
Affinity DataIC50: 4.40E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294745(3-Benzyl-4-[3-(benzyloxy)phenyl]-8-chlorocinnoline...)
Show SMILES Clc1cccc2c(c(Cc3ccccc3)nnc12)-c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C28H21ClN2O/c29-25-16-8-15-24-27(26(30-31-28(24)25)17-20-9-3-1-4-10-20)22-13-7-14-23(18-22)32-19-21-11-5-2-6-12-21/h1-16,18H,17,19H2
Affinity DataIC50: 4.60E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294754(3-Benzyl-4-(3-{[5-chloro-2-(trifluoromethyl)benzyl...)
Show SMILES FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(cccc12)C(F)(F)F
Show InChI InChI=1S/C30H19ClF6N2O/c31-21-12-13-24(29(32,33)34)20(15-21)17-40-22-9-4-8-19(16-22)27-23-10-5-11-25(30(35,36)37)28(23)39-38-26(27)14-18-6-2-1-3-7-18/h1-13,15-16H,14,17H2
Affinity DataIC50: 5.70E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294751(CHEMBL551584 | [3-(3-Benzyl-8-chlorocinnolin-4-yl)...)
Show SMILES Fc1ccc(c(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1)C(F)(F)F
Show InChI InChI=1S/C29H20ClF4N3/c30-25-11-5-10-23-27(26(36-37-28(23)25)14-18-6-2-1-3-7-18)19-8-4-9-22(16-19)35-17-20-15-21(31)12-13-24(20)29(32,33)34/h1-13,15-16,35H,14,17H2
Affinity DataIC50: 6.20E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294755(3-Benzyl-4-(3-{[2-fluoro-3-(trifluoromethyl)benzyl...)
Show SMILES Fc1c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)cccc1C(F)(F)F
Show InChI InChI=1S/C30H19F7N2O/c31-27-20(10-5-13-23(27)29(32,33)34)17-40-21-11-4-9-19(16-21)26-22-12-6-14-24(30(35,36)37)28(22)39-38-25(26)15-18-7-2-1-3-8-18/h1-14,16H,15,17H2
Affinity DataIC50: 6.30E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294752(8-Chloro-4-(3-{[5-chloro-2-(trifluoromethyl)benzyl...)
Show SMILES FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(nnc2c(Cl)cccc12)-c1ccccc1
Show InChI InChI=1S/C28H17Cl2F3N2O/c29-20-12-13-23(28(31,32)33)19(14-20)16-36-21-9-4-8-18(15-21)25-22-10-5-11-24(30)27(22)35-34-26(25)17-6-2-1-3-7-17/h1-15H,16H2
Affinity DataIC50: 6.50E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair
TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50294749(3-Benzyl-8-chloro-4-(3-{[5-chloro-2-(trifluorometh...)
Show SMILES FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(Cl)cccc12
Show InChI InChI=1S/C29H19Cl2F3N2O/c30-21-12-13-24(29(32,33)34)20(15-21)17-37-22-9-4-8-19(16-22)27-23-10-5-11-25(31)28(23)36-35-26(27)14-18-6-2-1-3-7-18/h1-13,15-16H,14,17H2
Affinity DataIC50: 8.50E+4nMAssay Description:Displacement of [3H]T0901317 from human recombinant N-terminal biotinylated tagged LXRbeta ligand binding domain (154-461) expressed in Escherichia c...More data for this Ligand-Target Pair