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Patent code US10668167

Compile Data Set for Download or QSAR
Found 176 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Progesterone receptor


(Homo sapiens (Human))
BDBM444986
PNG
(US10668167, Compound 3)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-3-7-21(8-4-18)42-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 2.60n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445033
PNG
(US10668167, Compound 41)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6/c1-33-13-12-25(38)16-23(33)10-11-26-27-17-30-35(29(40)19-37,34(27,2)18-28(39)31(26)33)42-32(41-30)22-8-6-20(7-9-22)14-21-4-3-5-24(36)15-21/h3-9,12-13,15-16,26-28,30-32,37,39H,10-11,14,17-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 2.80n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445027
PNG
(US10668167, Compound 35)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NCc2ccc(N)cc2)nc1
Show InChI InChI=1S/C34H38FN3O6/c1-31-12-11-23(40)13-21(31)6-9-24-25-14-28-34(27(42)18-39,32(25,2)15-26(41)33(24,31)35)44-30(43-28)20-5-10-29(38-17-20)37-16-19-3-7-22(36)8-4-19/h3-5,7-8,10-13,17,24-26,28,30,39,41H,6,9,14-16,18,36H2,1-2H3,(H,37,38)/t24-,25-,26-,28+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 3.40n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445028
PNG
(US10668167, Compound 36)
Show SMILES C[C@@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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n/an/a 3.40n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444986
PNG
(US10668167, Compound 3)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-3-7-21(8-4-18)42-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 3.60n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445051
PNG
(US10668167, Compound 63)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C34H37NO8S/c1-32-14-13-22(37)15-20(32)5-12-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)43-31(42-29)19-3-8-23(9-4-19)44(40,41)24-10-6-21(35)7-11-24/h3-4,6-11,13-15,25-27,29-31,36,38H,5,12,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445041
PNG
(US10668167, Compound 51)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C34H35F2NO8/c1-31-10-9-19(39)12-23(31)24(35)13-22-21-14-29-34(28(42)16-38,32(21,2)15-27(41)33(22,31)36)45-30(44-29)17-3-8-26(25(40)11-17)43-20-6-4-18(37)5-7-20/h3-12,21-22,24,27,29-30,38,40-41H,13-16,37H2,1-2H3/t21-,22-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 4.20n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445039
PNG
(US10668167, Compound 49)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H39NO7/c1-33-11-10-24(38)15-22(33)8-9-25-26-16-30-35(29(41)18-37,34(26,2)17-28(40)31(25)33)43-32(42-30)21-7-6-20(27(39)14-21)12-19-4-3-5-23(36)13-19/h3-7,10-11,13-15,25-26,28,30-32,37,39-40H,8-9,12,16-18,36H2,1-2H3/t25-,26-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 5.60n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445045
PNG
(US10668167, Compound 57)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-33-13-12-24(38)14-22(33)10-11-26-27-16-30-35(29(40)18-37,34(27,2)17-28(39)31(26)33)42-32(41-30)21-8-6-20(7-9-21)19-43-25-5-3-4-23(36)15-25/h3-9,12-15,26-28,30-32,37,39H,10-11,16-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445042
PNG
(US10668167, Compound 53)
Show SMILES C[C@@H](c1ccc(cc1)[C@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32-,33-,34-,35-,36+/m0/s1
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n/an/a 6.5n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445037
PNG
(US10668167, Compound 47)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-9-8-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-7-6-19(27(41)12-20)10-18-4-3-5-21(38)11-18/h3-9,11-13,23-24,26,28,30-31,39,41-42H,10,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 6.5n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444985
PNG
(US10668167, Compound 2)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H37NO7/c1-32-14-13-22(37)15-20(32)5-12-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)42-31(41-29)19-3-8-23(9-4-19)40-24-10-6-21(35)7-11-24/h3-4,6-11,13-15,25-27,29-31,36,38H,5,12,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445027
PNG
(US10668167, Compound 35)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NCc2ccc(N)cc2)nc1
Show InChI InChI=1S/C34H38FN3O6/c1-31-12-11-23(40)13-21(31)6-9-24-25-14-28-34(27(42)18-39,32(25,2)15-26(41)33(24,31)35)44-30(43-28)20-5-10-29(38-17-20)37-16-19-3-7-22(36)8-4-19/h3-5,7-8,10-13,17,24-26,28,30,39,41H,6,9,14-16,18,36H2,1-2H3,(H,37,38)/t24-,25-,26-,28+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445012
PNG
(US10668167, Compound 21)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-6-8-21(9-7-18)42-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445024
PNG
(US10668167, Compound 32)
Show SMILES COc1cc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)ccc1N
Show InChI InChI=1S/C36H39F2NO7/c1-33-11-10-22(41)14-25(33)26(37)15-24-23-16-31-36(30(43)18-40,34(23,2)17-29(42)35(24,33)38)46-32(45-31)21-7-4-19(5-8-21)12-20-6-9-27(39)28(13-20)44-3/h4-11,13-14,23-24,26,29,31-32,40,42H,12,15-18,39H2,1-3H3/t23-,24-,26-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445053
PNG
(US10668167, Compound 67)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-6-5-19(27(41)12-20)11-18-3-7-21(38)8-4-18/h3-10,12-13,23-24,26,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
PDB

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n/an/a 7.49n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445046
PNG
(US10668167, Compound 58)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-21(40)13-24(32)25(36)14-23-22-15-30-35(29(43)17-39,33(22,2)16-28(42)34(23,32)37)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-27(41)26(38)12-19/h3-10,12-13,22-23,25,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t22-,23-,25-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445040
PNG
(US10668167, Compound 50)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6S/c1-32-13-12-24(39)14-22(32)10-11-26-27-16-30-35(29(41)18-38,33(27,2)17-28(40)34(26,32)36)43-31(42-30)21-8-6-20(7-9-21)19-44-25-5-3-4-23(37)15-25/h3-9,12-15,26-28,30-31,38,40H,10-11,16-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445013
PNG
(US10668167, Compound 22)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445015
PNG
(US10668167, Compound 24)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-12-11-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-7-3-19(4-8-21)13-20-5-9-22(38)10-6-20/h3-12,14,24-25,27-28,30-31,39,41H,13,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445012
PNG
(US10668167, Compound 21)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-6-8-21(9-7-18)42-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445000
PNG
(US10668167, Compound 9)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-11-10-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-8-6-19(7-9-20)18-45-23-5-3-4-21(38)12-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445043
PNG
(US10668167, Compound 54)
Show SMILES C[C@@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444988
PNG
(US10668167, Compound 4)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-12-11-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-5-3-19(4-6-20)18-45-23-9-7-21(38)8-10-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445054
PNG
(US10668167, Compound 69)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-31-13-12-21(40)14-26(31)27(36)15-25-24-16-30-35(29(42)18-39,32(24,2)17-28(41)34(25,31)37)44-33(3,43-30)19-4-8-22(9-5-19)45-23-10-6-20(38)7-11-23/h4-14,24-25,27-28,30,39,41H,15-18,38H2,1-3H3/t24-,25-,27-,28-,30+,31-,32-,33+,34-,35+/m0/s1
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n/an/a 9.60n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445010
PNG
(US10668167, Compound 19)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-12-11-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-7-3-19(4-8-21)13-20-5-9-22(38)10-6-20/h3-12,14,24-25,27-28,30-31,39,41H,13,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445018
PNG
(US10668167, Compound 27)
Show SMILES CNc1ccc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)cc1
Show InChI InChI=1S/C36H39F2NO6/c1-33-13-12-24(41)15-27(33)28(37)16-26-25-17-31-36(30(43)19-40,34(25,2)18-29(42)35(26,33)38)45-32(44-31)22-8-4-20(5-9-22)14-21-6-10-23(39-3)11-7-21/h4-13,15,25-26,28-29,31-32,39-40,42H,14,16-19H2,1-3H3/t25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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n/an/a 10.2n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445001
PNG
(US10668167, Compound 10)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-6-8-21(9-7-18)44-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
PDB

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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445023
PNG
(US10668167, Compound 31)
Show SMILES CNc1ccc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)cc1OC
Show InChI InChI=1S/C37H41F2NO7/c1-34-12-11-23(42)15-26(34)27(38)16-25-24-17-32-37(31(44)19-41,35(24,2)18-30(43)36(25,34)39)47-33(46-32)22-8-5-20(6-9-22)13-21-7-10-28(40-3)29(14-21)45-4/h5-12,14-15,24-25,27,30,32-33,40-41,43H,13,16-19H2,1-4H3/t24-,25-,27-,30-,32+,33+,34-,35-,36-,37+/m0/s1
PDB

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n/an/a 10.7n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445014
PNG
(US10668167, Compound 23)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Oc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-6-8-21(9-7-18)42-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30-,31-,32-,33-,34+/m0/s1
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n/an/a 10.8n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445032
PNG
(US10668167, Compound 40)
Show SMILES C[C@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
PDB

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n/an/a 11.1n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445044
PNG
(US10668167, Compound 55)
Show SMILES C[C@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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n/an/a 11.4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445052
PNG
(US10668167, Compound 64)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-32-15-14-23(38)16-21(32)6-13-26-27-17-30-35(29(40)19-37,33(27,2)18-28(39)31(26)32)42-34(3,41-30)20-4-9-24(10-5-20)43-25-11-7-22(36)8-12-25/h4-5,7-12,14-16,26-28,30-31,37,39H,6,13,17-19,36H2,1-3H3/t26-,27-,28-,30+,31+,32-,33-,34+,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445000
PNG
(US10668167, Compound 9)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-11-10-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-8-6-19(7-9-20)18-45-23-5-3-4-21(38)12-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445038
PNG
(US10668167, Compound 48)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H39NO7/c1-33-12-11-23(38)15-22(33)8-9-24-25-16-30-35(29(41)18-37,34(25,2)17-28(40)31(24)33)43-32(42-30)21-6-3-19(4-7-21)13-20-5-10-27(39)26(36)14-20/h3-7,10-12,14-15,24-25,28,30-32,37,39-40H,8-9,13,16-18,36H2,1-2H3/t24-,25-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445054
PNG
(US10668167, Compound 69)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-31-13-12-21(40)14-26(31)27(36)15-25-24-16-30-35(29(42)18-39,32(24,2)17-28(41)34(25,31)37)44-33(3,43-30)19-4-8-22(9-5-19)45-23-10-6-20(38)7-11-23/h4-14,24-25,27-28,30,39,41H,15-18,38H2,1-3H3/t24-,25-,27-,28-,30+,31-,32-,33+,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444995
PNG
(US10668167, Compound 5)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-12-11-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-5-3-19(4-6-20)18-45-23-9-7-21(38)8-10-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445048
PNG
(US10668167, Compound 60)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H37NO6S/c1-32-13-12-22(37)14-20(32)8-11-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)41-31(40-29)19-6-9-23(10-7-19)42-24-5-3-4-21(35)15-24/h3-7,9-10,12-15,25-27,29-31,36,38H,8,11,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445026
PNG
(US10668167, Compound 34)
Show SMILES COc1cc(Cc2ccc(cc2)[C@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)ccc1N
Show InChI InChI=1S/C36H39F2NO7/c1-33-11-10-22(41)14-25(33)26(37)15-24-23-16-31-36(30(43)18-40,34(23,2)17-29(42)35(24,33)38)46-32(45-31)21-7-4-19(5-8-21)12-20-6-9-27(39)28(13-20)44-3/h4-11,13-14,23-24,26,29,31-32,40,42H,12,15-18,39H2,1-3H3/t23-,24-,26-,29-,31+,32-,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445034
PNG
(US10668167, Compound 42)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6/c1-32-13-12-25(39)16-23(32)10-11-26-27-17-30-35(29(41)19-38,33(27,2)18-28(40)34(26,32)36)43-31(42-30)22-8-6-20(7-9-22)14-21-4-3-5-24(37)15-21/h3-9,12-13,15-16,26-28,30-31,38,40H,10-11,14,17-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445047
PNG
(US10668167, Compound 59)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H36FNO6S/c1-31-13-12-22(38)14-20(31)8-11-25-26-16-29-34(28(40)18-37,32(26,2)17-27(39)33(25,31)35)42-30(41-29)19-6-9-23(10-7-19)43-24-5-3-4-21(36)15-24/h3-7,9-10,12-15,25-27,29-30,37,39H,8,11,16-18,36H2,1-2H3/t25-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445030
PNG
(US10668167, Compound 38)
Show SMILES C[C@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25-,26-,27-,29+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445024
PNG
(US10668167, Compound 32)
Show SMILES COc1cc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)ccc1N
Show InChI InChI=1S/C36H39F2NO7/c1-33-11-10-22(41)14-25(33)26(37)15-24-23-16-31-36(30(43)18-40,34(23,2)17-29(42)35(24,33)38)46-32(45-31)21-7-4-19(5-8-21)12-20-6-9-27(39)28(13-20)44-3/h4-11,13-14,23-24,26,29,31-32,40,42H,12,15-18,39H2,1-3H3/t23-,24-,26-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445029
PNG
(US10668167, Compound 37)
Show SMILES C[C@@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25+,26+,27+,29-,31-,32+,33+,34+,35-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445021
PNG
(US10668167, Compound 29)
Show SMILES CNc1cccc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)c1
Show InChI InChI=1S/C36H39F2NO6/c1-33-12-11-24(41)15-27(33)28(37)16-26-25-17-31-36(30(43)19-40,34(25,2)18-29(42)35(26,33)38)45-32(44-31)22-9-7-20(8-10-22)13-21-5-4-6-23(14-21)39-3/h4-12,14-15,25-26,28-29,31-32,39-40,42H,13,16-19H2,1-3H3/t25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445016
PNG
(US10668167, Compound 25)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6/c1-32-10-9-21(41)13-24(32)26(37)14-23-22-15-30-35(29(43)17-40,33(22,2)16-28(42)34(23,32)38)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-25(36)27(39)12-19/h3-10,12-13,22-23,26,28,30-31,40,42H,11,14-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 13.3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445047
PNG
(US10668167, Compound 59)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H36FNO6S/c1-31-13-12-22(38)14-20(31)8-11-25-26-16-29-34(28(40)18-37,32(26,2)17-27(39)33(25,31)35)42-30(41-29)19-6-9-23(10-7-19)43-24-5-3-4-21(36)15-24/h3-7,9-10,12-15,25-27,29-30,37,39H,8,11,16-18,36H2,1-2H3/t25-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 13.4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445041
PNG
(US10668167, Compound 51)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C34H35F2NO8/c1-31-10-9-19(39)12-23(31)24(35)13-22-21-14-29-34(28(42)16-38,32(21,2)15-27(41)33(22,31)36)45-30(44-29)17-3-8-26(25(40)11-17)43-20-6-4-18(37)5-7-20/h3-12,21-22,24,27,29-30,38,40-41H,13-16,37H2,1-2H3/t21-,22-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445015
PNG
(US10668167, Compound 24)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-12-11-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-7-3-19(4-8-21)13-20-5-9-22(38)10-6-20/h3-12,14,24-25,27-28,30-31,39,41H,13,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445002
PNG
(US10668167, Compound 11)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-11-10-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-8-6-19(7-9-20)18-45-23-5-3-4-21(38)12-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445020
PNG
(US10668167, Compound 28)
Show SMILES CNc1ccc(Cc2ccc(cc2)[C@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)cc1
Show InChI InChI=1S/C36H39F2NO6/c1-33-13-12-24(41)15-27(33)28(37)16-26-25-17-31-36(30(43)19-40,34(25,2)18-29(42)35(26,33)38)45-32(44-31)22-8-4-20(5-9-22)14-21-6-10-23(39-3)11-7-21/h4-13,15,25-26,28-29,31-32,39-40,42H,14,16-19H2,1-3H3/t25-,26-,28-,29-,31+,32-,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445006
PNG
(US10668167, Compound 15)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-25(36)27(39)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445004
PNG
(US10668167, Compound 13)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)c(Cl)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-27(39)25(36)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444998
PNG
(US10668167, Compound 7)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-3-7-21(8-4-18)44-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445001
PNG
(US10668167, Compound 10)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-6-8-21(9-7-18)44-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445031
PNG
(US10668167, Compound 39)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NC2(CC2)c2ccc(N)cc2)nc1
Show InChI InChI=1S/C36H40FN3O6/c1-32-12-11-24(42)15-22(32)6-9-25-26-16-29-36(28(44)19-41,33(26,2)17-27(43)35(25,32)37)46-31(45-29)20-3-10-30(39-18-20)40-34(13-14-34)21-4-7-23(38)8-5-21/h3-5,7-8,10-12,15,18,25-27,29,31,41,43H,6,9,13-14,16-17,19,38H2,1-2H3,(H,39,40)/t25-,26-,27-,29+,31+,32-,33-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445004
PNG
(US10668167, Compound 13)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)c(Cl)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-27(39)25(36)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM444998
PNG
(US10668167, Compound 7)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-3-7-21(8-4-18)44-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445006
PNG
(US10668167, Compound 15)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-25(36)27(39)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445025
PNG
(US10668167, Compound 33)
Show SMILES CNc1ccc(Cc2ccc(cc2)[C@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)cc1OC
Show InChI InChI=1S/C37H41F2NO7/c1-34-12-11-23(42)15-26(34)27(38)16-25-24-17-32-37(31(44)19-41,35(24,2)18-30(43)36(25,34)39)47-33(46-32)22-8-5-20(6-9-22)13-21-7-10-28(40-3)29(14-21)45-4/h5-12,14-15,24-25,27,30,32-33,40-41,43H,13,16-19H2,1-4H3/t24-,25-,27-,30-,32+,33-,34-,35-,36-,37+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445022
PNG
(US10668167, Compound 30)
Show SMILES CNc1cccc(Cc2ccc(cc2)[C@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)c1
Show InChI InChI=1S/C36H39F2NO6/c1-33-12-11-24(41)15-27(33)28(37)16-26-25-17-31-36(30(43)19-40,34(25,2)18-29(42)35(26,33)38)45-32(44-31)22-9-7-20(8-10-22)13-21-5-4-6-23(14-21)39-3/h4-12,14-15,25-26,28-29,31-32,39-40,42H,13,16-19H2,1-3H3/t25-,26-,28-,29-,31+,32-,33-,34-,35-,36+/m0/s1
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n/an/a 17.7n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
PDB

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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 19.4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM444988
PNG
(US10668167, Compound 4)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-12-11-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-5-3-19(4-6-20)18-45-23-9-7-21(38)8-10-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 19.8n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445055
PNG
(US10668167, Compound 70)
Show SMILES CC(C)[C@H](NC(=O)CCN1C(=O)C=CC1=O)C(=O)N[C@@H](C)C(=O)Nc1ccc(Oc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5CCC6=CC(=O)C=C[C@]6(C)[C@H]5[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)cc1
Show InChI InChI=1S/C49H56N4O12/c1-26(2)43(52-39(58)19-21-53-40(59)16-17-41(53)60)45(62)50-27(3)44(61)51-30-9-13-33(14-10-30)63-32-11-6-28(7-12-32)46-64-38-23-35-34-15-8-29-22-31(55)18-20-47(29,4)42(34)36(56)24-48(35,5)49(38,65-46)37(57)25-54/h6-7,9-14,16-18,20,22,26-27,34-36,38,42-43,46,54,56H,8,15,19,21,23-25H2,1-5H3,(H,50,62)(H,51,61)(H,52,58)/t27-,34-,35-,36-,38+,42+,43-,46+,47-,48-,49+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444999
PNG
(US10668167, Compound 8)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-3-7-21(8-4-18)44-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30-,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445050
PNG
(US10668167, Compound 62)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H35ClFNO6S/c1-31-12-11-20(39)13-19(31)5-9-23-24-15-29-34(28(41)17-38,32(24,2)16-27(40)33(23,31)36)43-30(42-29)18-3-6-21(7-4-18)44-22-8-10-25(35)26(37)14-22/h3-4,6-8,10-14,23-24,27,29-30,38,40H,5,9,15-17,37H2,1-2H3/t23-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445016
PNG
(US10668167, Compound 25)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6/c1-32-10-9-21(41)13-24(32)26(37)14-23-22-15-30-35(29(43)17-40,33(22,2)16-28(42)34(23,32)38)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-25(36)27(39)12-19/h3-10,12-13,22-23,26,28,30-31,40,42H,11,14-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445005
PNG
(US10668167, Compound 14)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H34ClF2NO6S/c1-31-10-9-18(40)11-23(31)25(36)13-22-21-14-29-34(28(42)16-39,32(21,2)15-27(41)33(22,31)37)44-30(43-29)17-3-5-19(6-4-17)45-20-7-8-24(35)26(38)12-20/h3-12,21-22,25,27,29-30,39,41H,13-16,38H2,1-2H3/t21-,22-,25-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445003
PNG
(US10668167, Compound 12)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-6-8-21(9-7-18)44-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30-,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445050
PNG
(US10668167, Compound 62)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H35ClFNO6S/c1-31-12-11-20(39)13-19(31)5-9-23-24-15-29-34(28(41)17-38,32(24,2)16-27(40)33(23,31)36)43-30(42-29)18-3-6-21(7-4-18)44-22-8-10-25(35)26(37)14-22/h3-4,6-8,10-14,23-24,27,29-30,38,40H,5,9,15-17,37H2,1-2H3/t23-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445005
PNG
(US10668167, Compound 14)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H34ClF2NO6S/c1-31-10-9-18(40)11-23(31)25(36)13-22-21-14-29-34(28(42)16-39,32(21,2)15-27(41)33(22,31)37)44-30(43-29)17-3-5-19(6-4-17)45-20-7-8-24(35)26(38)12-20/h3-12,21-22,25,27,29-30,39,41H,13-16,38H2,1-2H3/t21-,22-,25-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445017
PNG
(US10668167, Compound 26)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6/c1-32-10-9-21(41)13-24(32)26(37)14-23-22-15-30-35(29(43)17-40,33(22,2)16-28(42)34(23,32)38)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-25(36)27(39)12-19/h3-10,12-13,22-23,26,28,30-31,40,42H,11,14-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445036
PNG
(US10668167, Compound 46)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(O)=O)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6/c1-31-11-10-22(38)14-25(31)26(35)15-24-23-16-28-34(30(40)41,32(23,2)17-27(39)33(24,31)36)43-29(42-28)20-8-6-18(7-9-20)12-19-4-3-5-21(37)13-19/h3-11,13-14,23-24,26-29,39H,12,15-17,37H2,1-2H3,(H,40,41)/t23-,24-,26-,27-,28+,29+,31-,32-,33-,34-/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445008
PNG
(US10668167, Compound 17)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-25(36)27(39)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31-,32-,33-,34-,35+/m0/s1
PDB

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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445013
PNG
(US10668167, Compound 22)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31-,32-,33-,34-,35+/m0/s1
PDB

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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445049
PNG
(US10668167, Compound 61)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H36ClNO6S/c1-32-12-11-20(38)13-19(32)5-9-23-24-15-29-34(28(40)17-37,33(24,2)16-27(39)30(23)32)42-31(41-29)18-3-6-21(7-4-18)43-22-8-10-25(35)26(36)14-22/h3-4,6-8,10-14,23-24,27,29-31,37,39H,5,9,15-17,36H2,1-2H3/t23-,24-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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n/an/a 30.2n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445046
PNG
(US10668167, Compound 58)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-21(40)13-24(32)25(36)14-23-22-15-30-35(29(43)17-39,33(22,2)16-28(42)34(23,32)37)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-27(41)26(38)12-19/h3-10,12-13,22-23,25,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t22-,23-,25-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 34.1n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445040
PNG
(US10668167, Compound 50)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6S/c1-32-13-12-24(39)14-22(32)10-11-26-27-16-30-35(29(41)18-38,33(27,2)17-28(40)34(26,32)36)43-31(42-30)21-8-6-20(7-9-21)19-44-25-5-3-4-23(37)15-25/h3-9,12-15,26-28,30-31,38,40H,10-11,16-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 34.5n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445009
PNG
(US10668167, Compound 18)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H34ClF2NO6S/c1-31-10-9-18(40)11-23(31)25(36)13-22-21-14-29-34(28(42)16-39,32(21,2)15-27(41)33(22,31)37)44-30(43-29)17-3-5-19(6-4-17)45-20-7-8-24(35)26(38)12-20/h3-12,21-22,25,27,29-30,39,41H,13-16,38H2,1-2H3/t21-,22-,25-,27-,29+,30-,31-,32-,33-,34+/m0/s1
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n/an/a 43.7n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445028
PNG
(US10668167, Compound 36)
Show SMILES C[C@@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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n/an/a 52n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445043
PNG
(US10668167, Compound 54)
Show SMILES C[C@@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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n/an/a 52.7n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445007
PNG
(US10668167, Compound 16)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)c(Cl)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-27(39)25(36)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31-,32-,33-,34-,35+/m0/s1
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n/an/a 53.7n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM444997
PNG
(US10668167, Compound 6)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)SCCl)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37ClFNO5S2/c1-32-14-13-24(39)15-22(32)7-12-26-27-16-29-35(31(41)45-19-36,33(27,2)17-28(40)34(26,32)37)43-30(42-29)21-5-3-20(4-6-21)18-44-25-10-8-23(38)9-11-25/h3-6,8-11,13-15,26-30,40H,7,12,16-19,38H2,1-2H3/t26-,27-,28-,29+,30+,32-,33-,34-,35-/m0/s1
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n/an/a 64.1n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM445035
PNG
(US10668167, Compound 45)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)SCF)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H36F3NO5S/c1-32-11-10-23(40)14-26(32)27(37)15-25-24-16-29-35(31(42)45-18-36,33(24,2)17-28(41)34(25,32)38)44-30(43-29)21-8-6-19(7-9-21)12-20-4-3-5-22(39)13-20/h3-11,13-14,24-25,27-30,41H,12,15-18,39H2,1-2H3/t24-,25-,27-,28-,29+,30+,32-,33-,34-,35-/m0/s1
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n/an/a 66.1n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for glucocorticoid receptor (GR) binding using the Polarscreen™ Glucocorticoid Receptor Assay Kit, Red (ThermoFisher A 15...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445048
PNG
(US10668167, Compound 60)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H37NO6S/c1-32-13-12-22(37)14-20(32)8-11-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)41-31(40-29)19-6-9-23(10-7-19)42-24-5-3-4-21(35)15-24/h3-7,9-10,12-15,25-27,29-31,36,38H,8,11,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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n/an/a 69.9n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445033
PNG
(US10668167, Compound 41)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6/c1-33-13-12-25(38)16-23(33)10-11-26-27-17-30-35(29(40)19-37,34(27,2)18-28(39)31(26)33)42-32(41-30)22-8-6-20(7-9-22)14-21-4-3-5-24(36)15-21/h3-9,12-13,15-16,26-28,30-32,37,39H,10-11,14,17-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445035
PNG
(US10668167, Compound 45)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)SCF)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H36F3NO5S/c1-32-11-10-23(40)14-26(32)27(37)15-25-24-16-29-35(31(42)45-18-36,33(24,2)17-28(41)34(25,32)38)44-30(43-29)21-8-6-19(7-9-21)12-20-4-3-5-22(39)13-20/h3-11,13-14,24-25,27-30,41H,12,15-18,39H2,1-2H3/t24-,25-,27-,28-,29+,30+,32-,33-,34-,35-/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445034
PNG
(US10668167, Compound 42)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6/c1-32-13-12-25(39)16-23(32)10-11-26-27-17-30-35(29(41)19-38,33(27,2)18-28(40)34(26,32)36)43-31(42-30)22-8-6-20(7-9-22)14-21-4-3-5-24(37)15-21/h3-9,12-13,15-16,26-28,30-31,38,40H,10-11,14,17-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
PDB

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n/an/a 87.3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445045
PNG
(US10668167, Compound 57)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-33-13-12-24(38)14-22(33)10-11-26-27-16-30-35(29(40)18-37,34(27,2)17-28(39)31(26)33)42-32(41-30)21-8-6-20(7-9-21)19-43-25-5-3-4-23(36)15-25/h3-9,12-15,26-28,30-32,37,39H,10-11,16-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
PDB

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n/an/a 91.4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445044
PNG
(US10668167, Compound 55)
Show SMILES C[C@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
PDB

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n/an/a 93.3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445032
PNG
(US10668167, Compound 40)
Show SMILES C[C@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
PDB

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n/an/a 106n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445038
PNG
(US10668167, Compound 48)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H39NO7/c1-33-12-11-23(38)15-22(33)8-9-24-25-16-30-35(29(41)18-37,34(25,2)17-28(40)31(24)33)43-32(42-30)21-6-3-19(4-7-21)13-20-5-10-27(39)26(36)14-20/h3-7,10-12,14-15,24-25,28,30-32,37,39-40H,8-9,13,16-18,36H2,1-2H3/t24-,25-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 108n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445052
PNG
(US10668167, Compound 64)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-32-15-14-23(38)16-21(32)6-13-26-27-17-30-35(29(40)19-37,33(27,2)18-28(39)31(26)32)42-34(3,41-30)20-4-9-24(10-5-20)43-25-11-7-22(36)8-12-25/h4-5,7-12,14-16,26-28,30-31,37,39H,6,13,17-19,36H2,1-3H3/t26-,27-,28-,30+,31+,32-,33-,34+,35+/m0/s1
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n/an/a 121n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445031
PNG
(US10668167, Compound 39)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NC2(CC2)c2ccc(N)cc2)nc1
Show InChI InChI=1S/C36H40FN3O6/c1-32-12-11-24(42)15-22(32)6-9-25-26-16-29-36(28(44)19-41,33(26,2)17-27(43)35(25,32)37)46-31(45-29)20-3-10-30(39-18-20)40-34(13-14-34)21-4-7-23(38)8-5-21/h3-5,7-8,10-12,15,18,25-27,29,31,41,43H,6,9,13-14,16-17,19,38H2,1-2H3,(H,39,40)/t25-,26-,27-,29+,31+,32-,33-,35-,36+/m0/s1
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n/an/a 137n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445037
PNG
(US10668167, Compound 47)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-9-8-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-7-6-19(27(41)12-20)10-18-4-3-5-21(38)11-18/h3-9,11-13,23-24,26,28,30-31,39,41-42H,10,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 171n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445053
PNG
(US10668167, Compound 67)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-6-5-19(27(41)12-20)11-18-3-7-21(38)8-4-18/h3-10,12-13,23-24,26,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 181n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445027
PNG
(US10668167, Compound 35)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NCc2ccc(N)cc2)nc1
Show InChI InChI=1S/C34H38FN3O6/c1-31-12-11-23(40)13-21(31)6-9-24-25-14-28-34(27(42)18-39,32(25,2)15-26(41)33(24,31)35)44-30(43-28)20-5-10-29(38-17-20)37-16-19-3-7-22(36)8-4-19/h3-5,7-8,10-13,17,24-26,28,30,39,41H,6,9,14-16,18,36H2,1-2H3,(H,37,38)/t24-,25-,26-,28+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 256n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445051
PNG
(US10668167, Compound 63)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C34H37NO8S/c1-32-14-13-22(37)15-20(32)5-12-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)43-31(42-29)19-3-8-23(9-4-19)44(40,41)24-10-6-21(35)7-11-24/h3-4,6-11,13-15,25-27,29-31,36,38H,5,12,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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n/an/a 447n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 814n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445049
PNG
(US10668167, Compound 61)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H36ClNO6S/c1-32-12-11-20(38)13-19(32)5-9-23-24-15-29-34(28(40)17-37,33(24,2)16-27(39)30(23)32)42-31(41-29)18-3-6-21(7-4-18)43-22-8-10-25(35)26(36)14-22/h3-4,6-8,10-14,23-24,27,29-31,37,39H,5,9,15-17,36H2,1-2H3/t23-,24-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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n/an/a 839n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445029
PNG
(US10668167, Compound 37)
Show SMILES C[C@@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25+,26+,27+,29-,31-,32+,33+,34+,35-/m1/s1
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n/an/a 1.09E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445030
PNG
(US10668167, Compound 38)
Show SMILES C[C@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25-,26-,27-,29+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 1.19E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445036
PNG
(US10668167, Compound 46)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(O)=O)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6/c1-31-11-10-22(38)14-25(31)26(35)15-24-23-16-28-34(30(40)41,32(23,2)17-27(39)33(24,31)36)43-29(42-28)20-8-6-18(7-9-20)12-19-4-3-5-21(37)13-19/h3-11,13-14,23-24,26-29,39H,12,15-17,37H2,1-2H3,(H,40,41)/t23-,24-,26-,27-,28+,29+,31-,32-,33-,34-/m0/s1
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n/an/a 2.13E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM445039
PNG
(US10668167, Compound 49)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H39NO7/c1-33-11-10-24(38)15-22(33)8-9-25-26-16-30-35(29(41)18-37,34(26,2)17-28(40)31(25)33)43-32(42-30)21-7-6-20(27(39)14-21)12-19-4-3-5-23(36)13-19/h3-7,10-11,13-15,25-26,28,30-32,37,39-40H,8-9,12,16-18,36H2,1-2H3/t25-,26-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for progersterone receptor (PR) binding using a modification of the LanthaScreen® TR-FRET Progesterone Receptor Coactivat...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445005
PNG
(US10668167, Compound 14)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H34ClF2NO6S/c1-31-10-9-18(40)11-23(31)25(36)13-22-21-14-29-34(28(42)16-39,32(21,2)15-27(41)33(22,31)37)44-30(43-29)17-3-5-19(6-4-17)45-20-7-8-24(35)26(38)12-20/h3-12,21-22,25,27,29-30,39,41H,13-16,38H2,1-2H3/t21-,22-,25-,27-,29+,30+,31-,32-,33-,34+/m0/s1
PDB

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n/an/a 2.71E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445006
PNG
(US10668167, Compound 15)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-25(36)27(39)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
PDB

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n/an/a 3.77E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM444988
PNG
(US10668167, Compound 4)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-12-11-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-5-3-19(4-6-20)18-45-23-9-7-21(38)8-10-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
PDB
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n/an/a 3.99E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445001
PNG
(US10668167, Compound 10)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-6-8-21(9-7-18)44-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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n/an/a 5.13E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445046
PNG
(US10668167, Compound 58)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-21(40)13-24(32)25(36)14-23-22-15-30-35(29(43)17-39,33(22,2)16-28(42)34(23,32)37)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-27(41)26(38)12-19/h3-10,12-13,22-23,25,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t22-,23-,25-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 5.98E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445035
PNG
(US10668167, Compound 45)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)SCF)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H36F3NO5S/c1-32-11-10-23(40)14-26(32)27(37)15-25-24-16-29-35(31(42)45-18-36,33(24,2)17-28(41)34(25,32)38)44-30(43-29)21-8-6-19(7-9-21)12-20-4-3-5-22(39)13-20/h3-11,13-14,24-25,27-30,41H,12,15-18,39H2,1-2H3/t24-,25-,27-,28-,29+,30+,32-,33-,34-,35-/m0/s1
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n/an/a 6.48E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445030
PNG
(US10668167, Compound 38)
Show SMILES C[C@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25-,26-,27-,29+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 9.28E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445034
PNG
(US10668167, Compound 42)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6/c1-32-13-12-25(39)16-23(32)10-11-26-27-17-30-35(29(41)19-38,33(27,2)18-28(40)34(26,32)36)43-31(42-30)22-8-6-20(7-9-22)14-21-4-3-5-24(37)15-21/h3-9,12-13,15-16,26-28,30-31,38,40H,10-11,14,17-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 9.75E+3n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445035
PNG
(US10668167, Compound 45)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)SCF)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H36F3NO5S/c1-32-11-10-23(40)14-26(32)27(37)15-25-24-16-29-35(31(42)45-18-36,33(24,2)17-28(41)34(25,32)38)44-30(43-29)21-8-6-19(7-9-21)12-20-4-3-5-22(39)13-20/h3-11,13-14,24-25,27-30,41H,12,15-18,39H2,1-2H3/t24-,25-,27-,28-,29+,30+,32-,33-,34-,35-/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445036
PNG
(US10668167, Compound 46)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(O)=O)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6/c1-31-11-10-22(38)14-25(31)26(35)15-24-23-16-28-34(30(40)41,32(23,2)17-27(39)33(24,31)36)43-29(42-28)20-8-6-18(7-9-20)12-19-4-3-5-21(37)13-19/h3-11,13-14,23-24,26-29,39H,12,15-17,37H2,1-2H3,(H,40,41)/t23-,24-,26-,27-,28+,29+,31-,32-,33-,34-/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445038
PNG
(US10668167, Compound 48)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(O)c(N)c2)cc1
Show InChI InChI=1S/C35H39NO7/c1-33-12-11-23(38)15-22(33)8-9-24-25-16-30-35(29(41)18-37,34(25,2)17-28(40)31(24)33)43-32(42-30)21-6-3-19(4-7-21)13-20-5-10-27(39)26(36)14-20/h3-7,10-12,14-15,24-25,28,30-32,37,39-40H,8-9,13,16-18,36H2,1-2H3/t24-,25-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445051
PNG
(US10668167, Compound 63)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C34H37NO8S/c1-32-14-13-22(37)15-20(32)5-12-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)43-31(42-29)19-3-8-23(9-4-19)44(40,41)24-10-6-21(35)7-11-24/h3-4,6-11,13-15,25-27,29-31,36,38H,5,12,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445053
PNG
(US10668167, Compound 67)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-10-9-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-6-5-19(27(41)12-20)11-18-3-7-21(38)8-4-18/h3-10,12-13,23-24,26,28,30-31,39,41-42H,11,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM444998
PNG
(US10668167, Compound 7)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-3-7-21(8-4-18)44-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445000
PNG
(US10668167, Compound 9)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-11-10-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-8-6-19(7-9-20)18-45-23-5-3-4-21(38)12-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445028
PNG
(US10668167, Compound 36)
Show SMILES C[C@@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445029
PNG
(US10668167, Compound 37)
Show SMILES C[C@@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25+,26+,27+,29-,31-,32+,33+,34+,35-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445045
PNG
(US10668167, Compound 57)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-33-13-12-24(38)14-22(33)10-11-26-27-16-30-35(29(40)18-37,34(27,2)17-28(39)31(26)33)42-32(41-30)21-8-6-20(7-9-21)19-43-25-5-3-4-23(36)15-25/h3-9,12-15,26-28,30-32,37,39H,10-11,16-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445045
PNG
(US10668167, Compound 57)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-33-13-12-24(38)14-22(33)10-11-26-27-16-30-35(29(40)18-37,34(27,2)17-28(39)31(26)33)42-32(41-30)21-8-6-20(7-9-21)19-43-25-5-3-4-23(36)15-25/h3-9,12-15,26-28,30-32,37,39H,10-11,16-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445004
PNG
(US10668167, Compound 13)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)c(Cl)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-27(39)25(36)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445005
PNG
(US10668167, Compound 14)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H34ClF2NO6S/c1-31-10-9-18(40)11-23(31)25(36)13-22-21-14-29-34(28(42)16-39,32(21,2)15-27(41)33(22,31)37)44-30(43-29)17-3-5-19(6-4-17)45-20-7-8-24(35)26(38)12-20/h3-12,21-22,25,27,29-30,39,41H,13-16,38H2,1-2H3/t21-,22-,25-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445012
PNG
(US10668167, Compound 21)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-6-8-21(9-7-18)42-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445015
PNG
(US10668167, Compound 24)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-12-11-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-7-3-19(4-8-21)13-20-5-9-22(38)10-6-20/h3-12,14,24-25,27-28,30-31,39,41H,13,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445016
PNG
(US10668167, Compound 25)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6/c1-32-10-9-21(41)13-24(32)26(37)14-23-22-15-30-35(29(43)17-40,33(22,2)16-28(42)34(23,32)38)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-25(36)27(39)12-19/h3-10,12-13,22-23,26,28,30-31,40,42H,11,14-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445027
PNG
(US10668167, Compound 35)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NCc2ccc(N)cc2)nc1
Show InChI InChI=1S/C34H38FN3O6/c1-31-12-11-23(40)13-21(31)6-9-24-25-14-28-34(27(42)18-39,32(25,2)15-26(41)33(24,31)35)44-30(43-28)20-5-10-29(38-17-20)37-16-19-3-7-22(36)8-4-19/h3-5,7-8,10-13,17,24-26,28,30,39,41H,6,9,14-16,18,36H2,1-2H3,(H,37,38)/t24-,25-,26-,28+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445039
PNG
(US10668167, Compound 49)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H39NO7/c1-33-11-10-24(38)15-22(33)8-9-25-26-16-30-35(29(41)18-37,34(26,2)17-28(40)31(25)33)43-32(42-30)21-7-6-20(27(39)14-21)12-19-4-3-5-23(36)13-19/h3-7,10-11,13-15,25-26,28,30-32,37,39-40H,8-9,12,16-18,36H2,1-2H3/t25-,26-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445043
PNG
(US10668167, Compound 54)
Show SMILES C[C@@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445044
PNG
(US10668167, Compound 55)
Show SMILES C[C@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445054
PNG
(US10668167, Compound 69)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-31-13-12-21(40)14-26(31)27(36)15-25-24-16-30-35(29(42)18-39,32(24,2)17-28(41)34(25,31)37)44-33(3,43-30)19-4-8-22(9-5-19)45-23-10-6-20(38)7-11-23/h4-14,24-25,27-28,30,39,41H,15-18,38H2,1-3H3/t24-,25-,27-,28-,30+,31-,32-,33+,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM444998
PNG
(US10668167, Compound 7)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-3-7-21(8-4-18)44-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445004
PNG
(US10668167, Compound 13)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)c(Cl)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-27(39)25(36)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445024
PNG
(US10668167, Compound 32)
Show SMILES COc1cc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)ccc1N
Show InChI InChI=1S/C36H39F2NO7/c1-33-11-10-22(41)14-25(33)26(37)15-24-23-16-31-36(30(43)18-40,34(23,2)17-29(42)35(24,33)38)46-32(45-31)21-7-4-19(5-8-21)12-20-6-9-27(39)28(13-20)44-3/h4-11,13-14,23-24,26,29,31-32,40,42H,12,15-18,39H2,1-3H3/t23-,24-,26-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445027
PNG
(US10668167, Compound 35)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NCc2ccc(N)cc2)nc1
Show InChI InChI=1S/C34H38FN3O6/c1-31-12-11-23(40)13-21(31)6-9-24-25-14-28-34(27(42)18-39,32(25,2)15-26(41)33(24,31)35)44-30(43-28)20-5-10-29(38-17-20)37-16-19-3-7-22(36)8-4-19/h3-5,7-8,10-13,17,24-26,28,30,39,41H,6,9,14-16,18,36H2,1-2H3,(H,37,38)/t24-,25-,26-,28+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445028
PNG
(US10668167, Compound 36)
Show SMILES C[C@@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445029
PNG
(US10668167, Compound 37)
Show SMILES C[C@@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25+,26+,27+,29-,31-,32+,33+,34+,35-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445036
PNG
(US10668167, Compound 46)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(O)=O)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6/c1-31-11-10-22(38)14-25(31)26(35)15-24-23-16-28-34(30(40)41,32(23,2)17-27(39)33(24,31)36)43-29(42-28)20-8-6-18(7-9-20)12-19-4-3-5-21(37)13-19/h3-11,13-14,23-24,26-29,39H,12,15-17,37H2,1-2H3,(H,40,41)/t23-,24-,26-,27-,28+,29+,31-,32-,33-,34-/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445043
PNG
(US10668167, Compound 54)
Show SMILES C[C@@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445047
PNG
(US10668167, Compound 59)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H36FNO6S/c1-31-13-12-22(38)14-20(31)8-11-25-26-16-29-34(28(40)18-37,32(26,2)17-27(39)33(25,31)35)42-30(41-29)19-6-9-23(10-7-19)43-24-5-3-4-21(36)15-24/h3-7,9-10,12-15,25-27,29-30,37,39H,8,11,16-18,36H2,1-2H3/t25-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445049
PNG
(US10668167, Compound 61)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H36ClNO6S/c1-32-12-11-20(38)13-19(32)5-9-23-24-15-29-34(28(40)17-37,33(24,2)16-27(39)30(23)32)42-31(41-29)18-3-6-21(7-4-18)43-22-8-10-25(35)26(36)14-22/h3-4,6-8,10-14,23-24,27,29-31,37,39H,5,9,15-17,36H2,1-2H3/t23-,24-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445001
PNG
(US10668167, Compound 10)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO6S/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)43-30(42-29)18-6-8-21(9-7-18)44-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445030
PNG
(US10668167, Compound 38)
Show SMILES C[C@H](Nc1ccc(cn1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(N)cc1
Show InChI InChI=1S/C35H40FN3O6/c1-19(20-4-8-23(37)9-5-20)39-30-11-6-21(17-38-30)31-44-29-15-26-25-10-7-22-14-24(41)12-13-32(22,2)34(25,36)27(42)16-33(26,3)35(29,45-31)28(43)18-40/h4-6,8-9,11-14,17,19,25-27,29,31,40,42H,7,10,15-16,18,37H2,1-3H3,(H,38,39)/t19-,25-,26-,27-,29+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445041
PNG
(US10668167, Compound 51)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C34H35F2NO8/c1-31-10-9-19(39)12-23(31)24(35)13-22-21-14-29-34(28(42)16-38,32(21,2)15-27(41)33(22,31)36)45-30(44-29)17-3-8-26(25(40)11-17)43-20-6-4-18(37)5-7-20/h3-12,21-22,24,27,29-30,38,40-41H,13-16,37H2,1-2H3/t21-,22-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445048
PNG
(US10668167, Compound 60)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H37NO6S/c1-32-13-12-22(37)14-20(32)8-11-25-26-16-29-34(28(39)18-36,33(26,2)17-27(38)30(25)32)41-31(40-29)19-6-9-23(10-7-19)42-24-5-3-4-21(35)15-24/h3-7,9-10,12-15,25-27,29-31,36,38H,8,11,16-18,35H2,1-2H3/t25-,26-,27-,29+,30+,31+,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445052
PNG
(US10668167, Compound 64)
Show SMILES C[C@]1(O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1ccc(Sc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H39NO6S/c1-32-15-14-23(38)16-21(32)6-13-26-27-17-30-35(29(40)19-37,33(27,2)18-28(39)31(26)32)42-34(3,41-30)20-4-9-24(10-5-20)43-25-11-7-22(36)8-12-25/h4-5,7-12,14-16,26-28,30-31,37,39H,6,13,17-19,36H2,1-3H3/t26-,27-,28-,30+,31+,32-,33-,34+,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM444986
PNG
(US10668167, Compound 3)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-3-7-21(8-4-18)42-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445000
PNG
(US10668167, Compound 9)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-11-10-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-8-6-19(7-9-20)18-45-23-5-3-4-21(38)12-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445011
PNG
(US10668167, Compound 20)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-11-10-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-8-6-19(7-9-21)12-20-4-3-5-22(38)13-20/h3-11,13-14,24-25,27-28,30-31,39,41H,12,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445032
PNG
(US10668167, Compound 40)
Show SMILES C[C@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445034
PNG
(US10668167, Compound 42)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6/c1-32-13-12-25(39)16-23(32)10-11-26-27-17-30-35(29(41)19-38,33(27,2)18-28(40)34(26,32)36)43-31(42-30)22-8-6-20(7-9-22)14-21-4-3-5-24(37)15-21/h3-9,12-13,15-16,26-28,30-31,38,40H,10-11,14,17-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445037
PNG
(US10668167, Compound 47)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)c(O)c1
Show InChI InChI=1S/C35H37F2NO7/c1-32-9-8-22(40)13-25(32)26(36)14-24-23-15-30-35(29(43)17-39,33(23,2)16-28(42)34(24,32)37)45-31(44-30)20-7-6-19(27(41)12-20)10-18-4-3-5-21(38)11-18/h3-9,11-13,23-24,26,28,30-31,39,41-42H,10,14-17,38H2,1-2H3/t23-,24-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445041
PNG
(US10668167, Compound 51)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)c(O)c1
Show InChI InChI=1S/C34H35F2NO8/c1-31-10-9-19(39)12-23(31)24(35)13-22-21-14-29-34(28(42)16-38,32(21,2)15-27(41)33(22,31)36)45-30(44-29)17-3-8-26(25(40)11-17)43-20-6-4-18(37)5-7-20/h3-12,21-22,24,27,29-30,38,40-41H,13-16,37H2,1-2H3/t21-,22-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445044
PNG
(US10668167, Compound 55)
Show SMILES C[C@H](c1ccc(N)cc1)c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO
Show InChI InChI=1S/C36H39F2NO6/c1-19(21-8-10-23(39)11-9-21)20-4-6-22(7-5-20)32-44-31-16-25-26-15-28(37)27-14-24(41)12-13-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25-,26-,28-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445050
PNG
(US10668167, Compound 62)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Sc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C34H35ClFNO6S/c1-31-12-11-20(39)13-19(31)5-9-23-24-15-29-34(28(41)17-38,32(24,2)16-27(40)33(23,31)36)43-30(42-29)18-3-6-21(7-4-18)44-22-8-10-25(35)26(37)14-22/h3-4,6-8,10-14,23-24,27,29-30,38,40H,5,9,15-17,37H2,1-2H3/t23-,24-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM444986
PNG
(US10668167, Compound 3)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2ccc(N)cc2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-12-11-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-3-7-21(8-4-18)42-22-9-5-19(37)6-10-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445012
PNG
(US10668167, Compound 21)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Oc2cccc(N)c2)cc1
Show InChI InChI=1S/C34H35F2NO7/c1-31-11-10-20(39)13-25(31)26(35)14-24-23-15-29-34(28(41)17-38,32(23,2)16-27(40)33(24,31)36)44-30(43-29)18-6-8-21(9-7-18)42-22-5-3-4-19(37)12-22/h3-13,23-24,26-27,29-30,38,40H,14-17,37H2,1-2H3/t23-,24-,26-,27-,29+,30+,31-,32-,33-,34+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445031
PNG
(US10668167, Compound 39)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NC2(CC2)c2ccc(N)cc2)nc1
Show InChI InChI=1S/C36H40FN3O6/c1-32-12-11-24(42)15-22(32)6-9-25-26-16-29-36(28(44)19-41,33(26,2)17-27(43)35(25,32)37)46-31(45-29)20-3-10-30(39-18-20)40-34(13-14-34)21-4-7-23(38)8-5-21/h3-5,7-8,10-12,15,18,25-27,29,31,41,43H,6,9,13-14,16-17,19,38H2,1-2H3,(H,39,40)/t25-,26-,27-,29+,31+,32-,33-,35-,36+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445032
PNG
(US10668167, Compound 40)
Show SMILES C[C@H](c1ccc(cc1)[C@@H]1O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)c1cccc(N)c1
Show InChI InChI=1S/C36H39F2NO6/c1-19(22-5-4-6-23(39)13-22)20-7-9-21(10-8-20)32-44-31-16-25-26-15-28(37)27-14-24(41)11-12-33(27,2)35(26,38)29(42)17-34(25,3)36(31,45-32)30(43)18-40/h4-14,19,25-26,28-29,31-32,40,42H,15-18,39H2,1-3H3/t19-,25+,26+,28+,29+,31-,32-,33+,34+,35+,36-/m1/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445040
PNG
(US10668167, Compound 50)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6S/c1-32-13-12-24(39)14-22(32)10-11-26-27-16-30-35(29(41)18-38,33(27,2)17-28(40)34(26,32)36)43-31(42-30)21-8-6-20(7-9-21)19-44-25-5-3-4-23(37)15-25/h3-9,12-15,26-28,30-31,38,40H,10-11,16-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445040
PNG
(US10668167, Compound 50)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H38FNO6S/c1-32-13-12-24(39)14-22(32)10-11-26-27-16-30-35(29(41)18-38,33(27,2)17-28(40)34(26,32)36)43-31(42-30)21-8-6-20(7-9-21)19-44-25-5-3-4-23(37)15-25/h3-9,12-15,26-28,30-31,38,40H,10-11,16-19,37H2,1-2H3/t26-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM444988
PNG
(US10668167, Compound 4)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6S/c1-32-12-11-22(40)13-26(32)27(36)14-25-24-15-30-35(29(42)17-39,33(24,2)16-28(41)34(25,32)37)44-31(43-30)20-5-3-19(4-6-20)18-45-23-9-7-21(38)8-10-23/h3-13,24-25,27-28,30-31,39,41H,14-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445006
PNG
(US10668167, Compound 15)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(CSc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6S/c1-32-10-9-20(41)11-24(32)26(37)13-23-22-14-30-35(29(43)16-40,33(22,2)15-28(42)34(23,32)38)45-31(44-30)19-5-3-18(4-6-19)17-46-21-7-8-25(36)27(39)12-21/h3-12,22-23,26,28,30-31,40,42H,13-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445015
PNG
(US10668167, Compound 24)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C35H37F2NO6/c1-32-12-11-23(40)14-26(32)27(36)15-25-24-16-30-35(29(42)18-39,33(24,2)17-28(41)34(25,32)37)44-31(43-30)21-7-3-19(4-8-21)13-20-5-9-22(38)10-6-20/h3-12,14,24-25,27-28,30-31,39,41H,13,15-18,38H2,1-2H3/t24-,25-,27-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445016
PNG
(US10668167, Compound 25)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2ccc(Cl)c(N)c2)cc1
Show InChI InChI=1S/C35H36ClF2NO6/c1-32-10-9-21(41)13-24(32)26(37)14-23-22-15-30-35(29(43)17-40,33(22,2)16-28(42)34(23,32)38)45-31(44-30)20-6-3-18(4-7-20)11-19-5-8-25(36)27(39)12-19/h3-10,12-13,22-23,26,28,30-31,40,42H,11,14-17,39H2,1-2H3/t22-,23-,26-,28-,30+,31+,32-,33-,34-,35+/m0/s1
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AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445031
PNG
(US10668167, Compound 39)
Show SMILES C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(NC2(CC2)c2ccc(N)cc2)nc1
Show InChI InChI=1S/C36H40FN3O6/c1-32-12-11-24(42)15-22(32)6-9-25-26-16-29-36(28(44)19-41,33(26,2)17-27(43)35(25,32)37)46-31(45-29)20-3-10-30(39-18-20)40-34(13-14-34)21-4-7-23(38)8-5-21/h3-5,7-8,10-12,15,18,25-27,29,31,41,43H,6,9,13-14,16-17,19,38H2,1-2H3,(H,39,40)/t25-,26-,27-,29+,31+,32-,33-,35-,36+/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445033
PNG
(US10668167, Compound 41)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6/c1-33-13-12-25(38)16-23(33)10-11-26-27-17-30-35(29(40)19-37,34(27,2)18-28(39)31(26)33)42-32(41-30)22-8-6-20(7-9-22)14-21-4-3-5-24(36)15-21/h3-9,12-13,15-16,26-28,30-32,37,39H,10-11,14,17-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Androgen receptor/Baculoviral IAP repeat-containing protein 2


(Homo sapiens (Human))
BDBM445024
PNG
(US10668167, Compound 32)
Show SMILES COc1cc(Cc2ccc(cc2)[C@@H]2O[C@@H]3C[C@H]4[C@@H]5C[C@H](F)C6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]4(C)[C@@]3(O2)C(=O)CO)ccc1N
Show InChI InChI=1S/C36H39F2NO7/c1-33-11-10-22(41)14-25(33)26(37)15-24-23-16-31-36(30(43)18-40,34(23,2)17-29(42)35(24,33)38)46-32(45-31)21-7-4-19(5-8-21)12-20-6-9-27(39)28(13-20)44-3/h4-11,13-14,23-24,26,29,31-32,40,42H,12,15-18,39H2,1-3H3/t23-,24-,26-,29-,31+,32+,33-,34-,35-,36+/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for androgen receptor (AR) binding using a modification of the LanthaScreen® TR-FRET Androgen Receptor Coactivator Assay ...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2/Estrogen receptor


(Homo sapiens (Human))
BDBM445033
PNG
(US10668167, Compound 41)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@H]1O[C@H](O[C@@]21C(=O)CO)c1ccc(Cc2cccc(N)c2)cc1
Show InChI InChI=1S/C35H39NO6/c1-33-13-12-25(38)16-23(33)10-11-26-27-17-30-35(29(40)19-37,34(27,2)18-28(39)31(26)33)42-32(41-30)22-8-6-20(7-9-22)14-21-4-3-5-24(36)15-21/h3-9,12-13,15-16,26-28,30-32,37,39H,10-11,14,17-19,36H2,1-2H3/t26-,27-,28-,30+,31+,32+,33-,34-,35+/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
Small molecules were tested for estrogen receptor (ER) alpha binding using a modification of the LanthaScreen® TR-FRET Estrogen Receptor Alpha Coacti...


US Patent US10668167 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%