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PubMed code 16112571

Compile data set for download or QSAR
Found 93 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172022
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cc12
Show InChI InChI=1S/C22H20F4N2O5/c1-11-15-9-13(5-6-14(15)18(30)33-28-11)27-19(31)21(32,22(24,25)26)10-20(2,3)16-8-12(23)4-7-17(16)29/h4-9,29,32H,10H2,1-3H3,(H,27,31)
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n/an/a 4n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172021
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O
Show InChI InChI=1S/C21H19F4NO5/c1-19(2,15-8-12(22)3-6-16(15)27)10-20(30,21(23,24)25)18(29)26-13-4-5-14-11(7-13)9-31-17(14)28/h3-8,27,30H,9-10H2,1-2H3,(H,26,29)
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n/an/a 6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172020
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H33FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h9-14,18,32,35H,4-8,15-16H2,1-3H3,(H,30,34)
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n/an/a 7n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172032
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3ccccc3)cc12
Show InChI InChI=1S/C28H28N2O4/c1-19-24-16-22(14-15-23(24)25(31)34-30-19)29-26(32)28(33,17-20-10-6-4-7-11-20)18-27(2,3)21-12-8-5-9-13-21/h4-16,33H,17-18H2,1-3H3,(H,29,32)
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n/an/a 7n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172033
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H27FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h4-14,32,35H,15-16H2,1-3H3,(H,30,34)
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n/an/a 8n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 9n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 9n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172034
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3ccccc3)cc12
Show InChI InChI=1S/C28H34N2O4/c1-19-24-16-22(14-15-23(24)25(31)34-30-19)29-26(32)28(33,17-20-10-6-4-7-11-20)18-27(2,3)21-12-8-5-9-13-21/h5,8-9,12-16,20,33H,4,6-7,10-11,17-18H2,1-3H3,(H,29,32)
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n/an/a 9n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 9n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172023
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h3-15,31H,16-18H2,1-2H3,(H,28,30)
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n/an/a 13n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172021
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O
Show InChI InChI=1S/C21H19F4NO5/c1-19(2,15-8-12(22)3-6-16(15)27)10-20(30,21(23,24)25)18(29)26-13-4-5-14-11(7-13)9-31-17(14)28/h3-8,27,30H,9-10H2,1-2H3,(H,26,29)
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n/an/a 16n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 19n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172027
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H32FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h8-13,17,30,33H,3-7,14-16H2,1-2H3,(H,29,32)
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n/an/a 20n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172022
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cc12
Show InChI InChI=1S/C22H20F4N2O5/c1-11-15-9-13(5-6-14(15)18(30)33-28-11)27-19(31)21(32,22(24,25)26)10-20(2,3)16-8-12(23)4-7-17(16)29/h4-9,29,32H,10H2,1-3H3,(H,27,31)
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n/an/a 22n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172021
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O
Show InChI InChI=1S/C21H19F4NO5/c1-19(2,15-8-12(22)3-6-16(15)27)10-20(30,21(23,24)25)18(29)26-13-4-5-14-11(7-13)9-31-17(14)28/h3-8,27,30H,9-10H2,1-2H3,(H,26,29)
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n/an/a 30n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172023
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h3-15,31H,16-18H2,1-2H3,(H,28,30)
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n/an/a 30n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172032
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3ccccc3)cc12
Show InChI InChI=1S/C28H28N2O4/c1-19-24-16-22(14-15-23(24)25(31)34-30-19)29-26(32)28(33,17-20-10-6-4-7-11-20)18-27(2,3)21-12-8-5-9-13-21/h4-16,33H,17-18H2,1-3H3,(H,29,32)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172033
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H27FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h4-14,32,35H,15-16H2,1-3H3,(H,30,34)
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n/an/a 32n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172038
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1cccc(CC(O)(CC(C)(C)c2cc(F)ccc2O)C(=O)Nc2ccc3C(=O)OCc3c2)c1
Show InChI InChI=1S/C28H28FNO5/c1-17-5-4-6-18(11-17)14-28(34,16-27(2,3)23-13-20(29)7-10-24(23)31)26(33)30-21-8-9-22-19(12-21)15-35-25(22)32/h4-13,31,34H,14-16H2,1-3H3,(H,30,33)
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n/an/a 34n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172024
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H26FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h3-13,30,33H,14-16H2,1-2H3,(H,29,32)
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n/an/a 35n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172020
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H33FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h9-14,18,32,35H,4-8,15-16H2,1-3H3,(H,30,34)
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n/an/a 35n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172046
PNG
(2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C28H28FNO5/c1-27(2,23-14-20(29)9-12-24(23)34-3)17-28(33,15-18-7-5-4-6-8-18)26(32)30-21-10-11-22-19(13-21)16-35-25(22)31/h4-14,33H,15-17H2,1-3H3,(H,30,32)
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n/an/a 35n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172037
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1ccccc1CC(O)(CC(C)(C)c1cc(F)ccc1O)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C28H28FNO5/c1-17-6-4-5-7-18(17)14-28(34,16-27(2,3)23-13-20(29)8-11-24(23)31)26(33)30-21-9-10-22-19(12-21)15-35-25(22)32/h4-13,31,34H,14-16H2,1-3H3,(H,30,33)
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n/an/a 36n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172028
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-trifluoromethyl-pent...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C21H20F3NO4/c1-19(2,14-6-4-3-5-7-14)12-20(28,21(22,23)24)18(27)25-15-8-9-16-13(10-15)11-29-17(16)26/h3-10,28H,11-12H2,1-2H3,(H,25,27)
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n/an/a 36n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172034
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3ccccc3)cc12
Show InChI InChI=1S/C28H34N2O4/c1-19-24-16-22(14-15-23(24)25(31)34-30-19)29-26(32)28(33,17-20-10-6-4-7-11-20)18-27(2,3)21-12-8-5-9-13-21/h5,8-9,12-16,20,33H,4,6-7,10-11,17-18H2,1-3H3,(H,29,32)
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n/an/a 40n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172022
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cc12
Show InChI InChI=1S/C22H20F4N2O5/c1-11-15-9-13(5-6-14(15)18(30)33-28-11)27-19(31)21(32,22(24,25)26)10-20(2,3)16-8-12(23)4-7-17(16)29/h4-9,29,32H,10H2,1-3H3,(H,27,31)
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n/an/a 41n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172027
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H32FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h8-13,17,30,33H,3-7,14-16H2,1-2H3,(H,29,32)
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n/an/a 42n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172039
PNG
(2-Hydroxy-2-(3-hydroxy-benzyl)-4-methyl-4-phenyl-p...)
Show SMILES CC(C)(CC(O)(Cc1cccc(O)c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO5/c1-26(2,20-8-4-3-5-9-20)17-27(32,15-18-7-6-10-22(29)13-18)25(31)28-21-11-12-23-19(14-21)16-33-24(23)30/h3-14,29,32H,15-17H2,1-2H3,(H,28,31)
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n/an/a 44n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172047
PNG
(2-Hydroxy-2-(2-hydroxy-benzyl)-4-methyl-4-phenyl-p...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1O)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO5/c1-26(2,20-9-4-3-5-10-20)17-27(32,15-18-8-6-7-11-23(18)29)25(31)28-21-12-13-22-19(14-21)16-33-24(22)30/h3-14,29,32H,15-17H2,1-2H3,(H,28,31)
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n/an/a 47n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172037
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1ccccc1CC(O)(CC(C)(C)c1cc(F)ccc1O)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C28H28FNO5/c1-17-6-4-5-7-18(17)14-28(34,16-27(2,3)23-13-20(29)8-11-24(23)31)26(33)30-21-9-10-22-19(12-21)15-35-25(22)32/h4-13,31,34H,14-16H2,1-3H3,(H,30,33)
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n/an/a 48n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172042
PNG
(2-Hydroxy-4-methyl-2-naphthalen-2-ylmethyl-4-pheny...)
Show SMILES CC(C)(CC(O)(Cc1ccc2ccccc2c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C31H29NO4/c1-30(2,25-10-4-3-5-11-25)20-31(35,18-21-12-13-22-8-6-7-9-23(22)16-21)29(34)32-26-14-15-27-24(17-26)19-36-28(27)33/h3-17,35H,18-20H2,1-2H3,(H,32,34)
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n/an/a 48n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172045
PNG
(2-(3,5-Dimethyl-benzyl)-4-(5-fluoro-2-hydroxy-phen...)
Show SMILES Cc1cc(C)cc(CC(O)(CC(C)(C)c2cc(F)ccc2O)C(=O)Nc2ccc3C(=O)OCc3c2)c1
Show InChI InChI=1S/C29H30FNO5/c1-17-9-18(2)11-19(10-17)14-29(35,16-28(3,4)24-13-21(30)5-8-25(24)32)27(34)31-22-6-7-23-20(12-22)15-36-26(23)33/h5-13,32,35H,14-16H2,1-4H3,(H,31,34)
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n/an/a 51n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172046
PNG
(2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C28H28FNO5/c1-27(2,23-14-20(29)9-12-24(23)34-3)17-28(33,15-18-7-5-4-6-8-18)26(32)30-21-10-11-22-19(13-21)16-35-25(22)31/h4-14,33H,15-17H2,1-3H3,(H,30,32)
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n/an/a 52n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172038
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1cccc(CC(O)(CC(C)(C)c2cc(F)ccc2O)C(=O)Nc2ccc3C(=O)OCc3c2)c1
Show InChI InChI=1S/C28H28FNO5/c1-17-5-4-6-18(11-17)14-28(34,16-27(2,3)23-13-20(29)7-10-24(23)31)26(33)30-21-8-9-22-19(12-21)15-35-25(22)32/h4-13,31,34H,14-16H2,1-3H3,(H,30,33)
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n/an/a 52n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172041
PNG
(2-Hydroxy-4-methyl-2-phenethyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)(CC(O)(CCc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C28H29NO4/c1-27(2,22-11-7-4-8-12-22)19-28(32,16-15-20-9-5-3-6-10-20)26(31)29-23-13-14-24-21(17-23)18-33-25(24)30/h3-14,17,32H,15-16,18-19H2,1-2H3,(H,29,31)
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n/an/a 57n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172041
PNG
(2-Hydroxy-4-methyl-2-phenethyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)(CC(O)(CCc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C28H29NO4/c1-27(2,22-11-7-4-8-12-22)19-28(32,16-15-20-9-5-3-6-10-20)26(31)29-23-13-14-24-21(17-23)18-33-25(24)30/h3-14,17,32H,15-16,18-19H2,1-2H3,(H,29,31)
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n/an/a 59n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172040
PNG
(2-Hydroxy-2,4-dimethyl-4-phenyl-pentanoic acid (1-...)
Show SMILES CC(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C21H23NO4/c1-20(2,15-7-5-4-6-8-15)13-21(3,25)19(24)22-16-9-10-17-14(11-16)12-26-18(17)23/h4-11,25H,12-13H2,1-3H3,(H,22,24)
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n/an/a 60n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172024
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H26FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h3-13,30,33H,14-16H2,1-2H3,(H,29,32)
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n/an/a 60n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172047
PNG
(2-Hydroxy-2-(2-hydroxy-benzyl)-4-methyl-4-phenyl-p...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1O)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO5/c1-26(2,20-9-4-3-5-10-20)17-27(32,15-18-8-6-7-11-23(18)29)25(31)28-21-12-13-22-19(14-21)16-33-24(22)30/h3-14,29,32H,15-17H2,1-2H3,(H,28,31)
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n/an/a 61n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172035
PNG
(2-(4-tert-Butyl-benzyl)-2-hydroxy-4-methyl-4-pheny...)
Show SMILES CC(C)(C)c1ccc(CC(O)(CC(C)(C)c2ccccc2)C(=O)Nc2ccc3C(=O)OCc3c2)cc1
Show InChI InChI=1S/C31H35NO4/c1-29(2,3)23-13-11-21(12-14-23)18-31(35,20-30(4,5)24-9-7-6-8-10-24)28(34)32-25-15-16-26-22(17-25)19-36-27(26)33/h6-17,35H,18-20H2,1-5H3,(H,32,34)
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n/an/a 72n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172028
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-trifluoromethyl-pent...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C21H20F3NO4/c1-19(2,14-6-4-3-5-7-14)12-20(28,21(22,23)24)18(27)25-15-8-9-16-13(10-15)11-29-17(16)26/h3-10,28H,11-12H2,1-2H3,(H,25,27)
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n/an/a 79n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172019
PNG
(5-[2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydrox...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2C(=O)OCc2c1)Cc1ccccc1
Show InChI InChI=1S/C28H30FNO4/c1-27(2,24-14-21(29)9-12-25(24)33-3)17-28(32,15-19-7-5-4-6-8-19)18-30-22-10-11-23-20(13-22)16-34-26(23)31/h4-14,30,32H,15-18H2,1-3H3
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n/an/a 80n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172019
PNG
(5-[2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydrox...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2C(=O)OCc2c1)Cc1ccccc1
Show InChI InChI=1S/C28H30FNO4/c1-27(2,24-14-21(29)9-12-25(24)33-3)17-28(32,15-19-7-5-4-6-8-19)18-30-22-10-11-23-20(13-22)16-34-26(23)31/h4-14,30,32H,15-18H2,1-3H3
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n/an/a 81n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172040
PNG
(2-Hydroxy-2,4-dimethyl-4-phenyl-pentanoic acid (1-...)
Show SMILES CC(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C21H23NO4/c1-20(2,15-7-5-4-6-8-15)13-21(3,25)19(24)22-16-9-10-17-14(11-16)12-26-18(17)23/h4-11,25H,12-13H2,1-3H3,(H,22,24)
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n/an/a 85n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172036
PNG
(4-(5-Fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F
Show InChI InChI=1S/C22H21F4NO5/c1-20(2,16-9-13(23)4-7-17(16)31-3)11-21(30,22(24,25)26)19(29)27-14-5-6-15-12(8-14)10-32-18(15)28/h4-9,30H,10-11H2,1-3H3,(H,27,29)
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n/an/a 85n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172033
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H27FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h4-14,32,35H,15-16H2,1-3H3,(H,30,34)
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n/an/a 104n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172020
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H33FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h9-14,18,32,35H,4-8,15-16H2,1-3H3,(H,30,34)
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n/an/a 104n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172042
PNG
(2-Hydroxy-4-methyl-2-naphthalen-2-ylmethyl-4-pheny...)
Show SMILES CC(C)(CC(O)(Cc1ccc2ccccc2c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C31H29NO4/c1-30(2,25-10-4-3-5-11-25)20-31(35,18-21-12-13-22-8-6-7-9-23(22)16-21)29(34)32-26-14-15-27-24(17-26)19-36-28(27)33/h3-17,35H,18-20H2,1-2H3,(H,32,34)
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n/an/a 110n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172039
PNG
(2-Hydroxy-2-(3-hydroxy-benzyl)-4-methyl-4-phenyl-p...)
Show SMILES CC(C)(CC(O)(Cc1cccc(O)c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO5/c1-26(2,20-8-4-3-5-9-20)17-27(32,15-18-7-6-10-22(29)13-18)25(31)28-21-11-12-23-19(14-21)16-33-24(23)30/h3-14,29,32H,15-17H2,1-2H3,(H,28,31)
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n/an/a 120n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172027
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H32FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h8-13,17,30,33H,3-7,14-16H2,1-2H3,(H,29,32)
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n/an/a 140n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172023
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h3-15,31H,16-18H2,1-2H3,(H,28,30)
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n/an/a 160n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172043
PNG
(2-(3,5-Dihydroxy-benzyl)-2-hydroxy-4-methyl-4-phen...)
Show SMILES CC(C)(CC(O)(Cc1cc(O)cc(O)c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO6/c1-26(2,19-6-4-3-5-7-19)16-27(33,14-17-10-21(29)13-22(30)11-17)25(32)28-20-8-9-23-18(12-20)15-34-24(23)31/h3-13,29-30,33H,14-16H2,1-2H3,(H,28,32)
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n/an/a 160n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 170n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172035
PNG
(2-(4-tert-Butyl-benzyl)-2-hydroxy-4-methyl-4-pheny...)
Show SMILES CC(C)(C)c1ccc(CC(O)(CC(C)(C)c2ccccc2)C(=O)Nc2ccc3C(=O)OCc3c2)cc1
Show InChI InChI=1S/C31H35NO4/c1-29(2,3)23-13-11-21(12-14-23)18-31(35,20-30(4,5)24-9-7-6-8-10-24)28(34)32-25-15-16-26-22(17-25)19-36-27(26)33/h6-17,35H,18-20H2,1-5H3,(H,32,34)
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n/an/a 175n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172044
PNG
(2-Biphenyl-4-ylmethyl-2-hydroxy-4-methyl-4-phenyl-...)
Show SMILES CC(C)(CC(O)(Cc1ccc(cc1)-c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C33H31NO4/c1-32(2,27-11-7-4-8-12-27)22-33(37,20-23-13-15-25(16-14-23)24-9-5-3-6-10-24)31(36)34-28-17-18-29-26(19-28)21-38-30(29)35/h3-19,37H,20-22H2,1-2H3,(H,34,36)
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n/an/a 180n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172024
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H26FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h3-13,30,33H,14-16H2,1-2H3,(H,29,32)
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n/an/a 190n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172019
PNG
(5-[2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydrox...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2C(=O)OCc2c1)Cc1ccccc1
Show InChI InChI=1S/C28H30FNO4/c1-27(2,24-14-21(29)9-12-25(24)33-3)17-28(32,15-19-7-5-4-6-8-19)18-30-22-10-11-23-20(13-22)16-34-26(23)31/h4-14,30,32H,15-18H2,1-3H3
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n/an/a 195n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172030
PNG
(2-Hydroxy-2-isopropyl-4-methyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)C(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C23H27NO4/c1-15(2)23(27,14-22(3,4)17-8-6-5-7-9-17)21(26)24-18-10-11-19-16(12-18)13-28-20(19)25/h5-12,15,27H,13-14H2,1-4H3,(H,24,26)
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n/an/a 200n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172030
PNG
(2-Hydroxy-2-isopropyl-4-methyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)C(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C23H27NO4/c1-15(2)23(27,14-22(3,4)17-8-6-5-7-9-17)21(26)24-18-10-11-19-16(12-18)13-28-20(19)25/h5-12,15,27H,13-14H2,1-4H3,(H,24,26)
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n/an/a 210n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/a 210n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172028
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-trifluoromethyl-pent...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C21H20F3NO4/c1-19(2,14-6-4-3-5-7-14)12-20(28,21(22,23)24)18(27)25-15-8-9-16-13(10-15)11-29-17(16)26/h3-10,28H,11-12H2,1-2H3,(H,25,27)
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n/an/a 215n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172036
PNG
(4-(5-Fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F
Show InChI InChI=1S/C22H21F4NO5/c1-20(2,16-9-13(23)4-7-17(16)31-3)11-21(30,22(24,25)26)19(29)27-14-5-6-15-12(8-14)10-32-18(15)28/h4-9,30H,10-11H2,1-3H3,(H,27,29)
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n/an/a 230n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172031
PNG
(2-Hydroxy-4-methyl-2,4-diphenyl-pentanoic acid (1-...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H25NO4/c1-25(2,19-9-5-3-6-10-19)17-26(30,20-11-7-4-8-12-20)24(29)27-21-13-14-22-18(15-21)16-31-23(22)28/h3-15,30H,16-17H2,1-2H3,(H,27,29)
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n/an/a 240n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50172030
PNG
(2-Hydroxy-2-isopropyl-4-methyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)C(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C23H27NO4/c1-15(2)23(27,14-22(3,4)17-8-6-5-7-9-17)21(26)24-18-10-11-19-16(12-18)13-28-20(19)25/h5-12,15,27H,13-14H2,1-4H3,(H,24,26)
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n/an/a 315n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards mineralocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172035
PNG
(2-(4-tert-Butyl-benzyl)-2-hydroxy-4-methyl-4-pheny...)
Show SMILES CC(C)(C)c1ccc(CC(O)(CC(C)(C)c2ccccc2)C(=O)Nc2ccc3C(=O)OCc3c2)cc1
Show InChI InChI=1S/C31H35NO4/c1-29(2,3)23-13-11-21(12-14-23)18-31(35,20-30(4,5)24-9-7-6-8-10-24)28(34)32-25-15-16-26-22(17-25)19-36-27(26)33/h6-17,35H,18-20H2,1-5H3,(H,32,34)
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n/an/a 330n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172040
PNG
(2-Hydroxy-2,4-dimethyl-4-phenyl-pentanoic acid (1-...)
Show SMILES CC(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C21H23NO4/c1-20(2,15-7-5-4-6-8-15)13-21(3,25)19(24)22-16-9-10-17-14(11-16)12-26-18(17)23/h4-11,25H,12-13H2,1-3H3,(H,22,24)
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n/an/a 370n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172026
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-pyridin-2-ylmethyl-p...)
Show SMILES CC(C)(CC(O)(Cc1ccccn1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C26H26N2O4/c1-25(2,19-8-4-3-5-9-19)17-26(31,15-21-10-6-7-13-27-21)24(30)28-20-11-12-22-18(14-20)16-32-23(22)29/h3-14,31H,15-17H2,1-2H3,(H,28,30)
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n/an/a 400n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172031
PNG
(2-Hydroxy-4-methyl-2,4-diphenyl-pentanoic acid (1-...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H25NO4/c1-25(2,19-9-5-3-6-10-19)17-26(30,20-11-7-4-8-12-20)24(29)27-21-13-14-22-18(15-21)16-31-23(22)28/h3-15,30H,16-17H2,1-2H3,(H,27,29)
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n/an/a 460n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172045
PNG
(2-(3,5-Dimethyl-benzyl)-4-(5-fluoro-2-hydroxy-phen...)
Show SMILES Cc1cc(C)cc(CC(O)(CC(C)(C)c2cc(F)ccc2O)C(=O)Nc2ccc3C(=O)OCc3c2)c1
Show InChI InChI=1S/C29H30FNO5/c1-17-9-18(2)11-19(10-17)14-29(35,16-28(3,4)24-13-21(30)5-8-25(24)32)27(34)31-22-6-7-23-20(12-22)15-36-26(23)33/h5-13,32,35H,14-16H2,1-4H3,(H,31,34)
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n/an/a 470n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172044
PNG
(2-Biphenyl-4-ylmethyl-2-hydroxy-4-methyl-4-phenyl-...)
Show SMILES CC(C)(CC(O)(Cc1ccc(cc1)-c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C33H31NO4/c1-32(2,27-11-7-4-8-12-27)22-33(37,20-23-13-15-25(16-14-23)24-9-5-3-6-10-24)31(36)34-28-17-18-29-26(19-28)21-38-30(29)35/h3-19,37H,20-22H2,1-2H3,(H,34,36)
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n/an/a 740n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172026
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-pyridin-2-ylmethyl-p...)
Show SMILES CC(C)(CC(O)(Cc1ccccn1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C26H26N2O4/c1-25(2,19-8-4-3-5-9-19)17-26(31,15-21-10-6-7-13-27-21)24(30)28-20-11-12-22-18(14-20)16-32-23(22)29/h3-14,31H,15-17H2,1-2H3,(H,28,30)
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n/an/a 760n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172029
PNG
(2-Hydroxy-4-methyl-4-phenyl-pentanoic acid (1-oxo-...)
Show SMILES CC(C)(CC(O)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C20H21NO4/c1-20(2,14-6-4-3-5-7-14)11-17(22)18(23)21-15-8-9-16-13(10-15)12-25-19(16)24/h3-10,17,22H,11-12H2,1-2H3,(H,21,23)
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n/an/a>2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172043
PNG
(2-(3,5-Dihydroxy-benzyl)-2-hydroxy-4-methyl-4-phen...)
Show SMILES CC(C)(CC(O)(Cc1cc(O)cc(O)c1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO6/c1-26(2,19-6-4-3-5-7-19)16-27(33,14-17-10-21(29)13-22(30)11-17)25(32)28-20-8-9-23-18(12-20)15-34-24(23)31/h3-13,29-30,33H,14-16H2,1-2H3,(H,28,32)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172029
PNG
(2-Hydroxy-4-methyl-4-phenyl-pentanoic acid (1-oxo-...)
Show SMILES CC(C)(CC(O)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C20H21NO4/c1-20(2,14-6-4-3-5-7-14)11-17(22)18(23)21-15-8-9-16-13(10-15)12-25-19(16)24/h3-10,17,22H,11-12H2,1-2H3,(H,21,23)
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n/an/a>2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50172048
PNG
(2-Benzyl-4-methyl-4-phenyl-pentanoic acid (1-oxo-1...)
Show SMILES CC(C)(CC(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO3/c1-27(2,22-11-7-4-8-12-22)17-20(15-19-9-5-3-6-10-19)25(29)28-23-13-14-24-21(16-23)18-31-26(24)30/h3-14,16,20H,15,17-18H2,1-2H3,(H,28,29)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172048
PNG
(2-Benzyl-4-methyl-4-phenyl-pentanoic acid (1-oxo-1...)
Show SMILES CC(C)(CC(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO3/c1-27(2,22-11-7-4-8-12-22)17-20(15-19-9-5-3-6-10-19)25(29)28-23-13-14-24-21(16-23)18-31-26(24)30/h3-14,16,20H,15,17-18H2,1-2H3,(H,28,29)
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n/an/a>2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards glucocorticoid receptor using fluorescence polarization competitive binding assay

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM18627
PNG
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)
Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|
Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1
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n/an/an/an/a 2n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172030
PNG
(2-Hydroxy-2-isopropyl-4-methyl-4-phenyl-pentanoic ...)
Show SMILES CC(C)C(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C23H27NO4/c1-15(2)23(27,14-22(3,4)17-8-6-5-7-9-17)21(26)24-18-10-11-19-16(12-18)13-28-20(19)25/h5-12,15,27H,13-14H2,1-4H3,(H,24,26)
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n/an/an/an/a 620n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172025
PNG
(2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pen...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H33NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h4,7-8,11-15,19,31H,3,5-6,9-10,16-18H2,1-2H3,(H,28,30)
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n/an/an/an/a 140n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM18207
PNG
((1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dih...)
Show SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24|
Show InChI InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
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n/an/an/an/a 1n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective agonist concentration for transcriptional repression of IL-6 production in IL-1 stimulated human foreskin fibroblasts

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172033
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H27FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h4-14,32,35H,15-16H2,1-3H3,(H,30,34)
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n/an/an/an/a 130n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172019
PNG
(5-[2-Benzyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydrox...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2C(=O)OCc2c1)Cc1ccccc1
Show InChI InChI=1S/C28H30FNO4/c1-27(2,24-14-21(29)9-12-25(24)33-3)17-28(32,15-19-7-5-4-6-8-19)18-30-22-10-11-23-20(13-22)16-34-26(23)31/h4-14,30,32H,15-18H2,1-3H3
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n/an/an/an/a 610n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172022
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cc12
Show InChI InChI=1S/C22H20F4N2O5/c1-11-15-9-13(5-6-14(15)18(30)33-28-11)27-19(31)21(32,22(24,25)26)10-20(2,3)16-8-12(23)4-7-17(16)29/h4-9,29,32H,10H2,1-3H3,(H,27,31)
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n/an/an/an/a 10n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective agonist concentration for transcriptional repression of IL-6 production in IL-1 stimulated human foreskin fibroblasts

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172023
PNG
(2-Benzyl-2-hydroxy-4-methyl-4-phenyl-pentanoic aci...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1
Show InChI InChI=1S/C27H27NO4/c1-26(2,21-11-7-4-8-12-21)18-27(31,16-19-9-5-3-6-10-19)25(30)28-22-13-14-23-20(15-22)17-32-24(23)29/h3-15,31H,16-18H2,1-2H3,(H,28,30)
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n/an/an/an/a 205n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172020
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3cc(F)ccc3O)cc12
Show InChI InChI=1S/C28H33FN2O5/c1-17-22-14-20(10-11-21(22)25(33)36-31-17)30-26(34)28(35,15-18-7-5-4-6-8-18)16-27(2,3)23-13-19(29)9-12-24(23)32/h9-14,18,32,35H,4-8,15-16H2,1-3H3,(H,30,34)
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n/an/an/an/a 120n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172027
PNG
(2-Cyclohexylmethyl-4-(5-fluoro-2-hydroxy-phenyl)-2...)
Show SMILES CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H32FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h8-13,17,30,33H,3-7,14-16H2,1-2H3,(H,29,32)
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n/an/an/an/a 130n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172024
PNG
(2-Benzyl-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4...)
Show SMILES CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O
Show InChI InChI=1S/C27H26FNO5/c1-26(2,22-13-19(28)8-11-23(22)30)16-27(33,14-17-6-4-3-5-7-17)25(32)29-20-9-10-21-18(12-20)15-34-24(21)31/h3-13,30,33H,14-16H2,1-2H3,(H,29,32)
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n/an/an/an/a 420n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172021
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O
Show InChI InChI=1S/C21H19F4NO5/c1-19(2,15-8-12(22)3-6-16(15)27)10-20(30,21(23,24)25)18(29)26-13-4-5-14-11(7-13)9-31-17(14)28/h3-8,27,30H,9-10H2,1-2H3,(H,26,29)
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n/an/an/an/a 150n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172035
PNG
(2-(4-tert-Butyl-benzyl)-2-hydroxy-4-methyl-4-pheny...)
Show SMILES CC(C)(C)c1ccc(CC(O)(CC(C)(C)c2ccccc2)C(=O)Nc2ccc3C(=O)OCc3c2)cc1
Show InChI InChI=1S/C31H35NO4/c1-29(2,3)23-13-11-21(12-14-23)18-31(35,20-30(4,5)24-9-7-6-8-10-24)28(34)32-25-15-16-26-22(17-25)19-36-27(26)33/h6-17,35H,18-20H2,1-5H3,(H,32,34)
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n/an/an/an/a 760n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172040
PNG
(2-Hydroxy-2,4-dimethyl-4-phenyl-pentanoic acid (1-...)
Show SMILES CC(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C21H23NO4/c1-20(2,15-7-5-4-6-8-15)13-21(3,25)19(24)22-16-9-10-17-14(11-16)12-26-18(17)23/h4-11,25H,12-13H2,1-3H3,(H,22,24)
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n/an/an/an/a 2.37E+3n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172021
PNG
(4-(5-Fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O
Show InChI InChI=1S/C21H19F4NO5/c1-19(2,15-8-12(22)3-6-16(15)27)10-20(30,21(23,24)25)18(29)26-13-4-5-14-11(7-13)9-31-17(14)28/h3-8,27,30H,9-10H2,1-2H3,(H,26,29)
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n/an/an/an/a 45n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective agonist concentration for transcriptional repression of IL-6 production in IL-1 stimulated human foreskin fibroblasts

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50172028
PNG
(2-Hydroxy-4-methyl-4-phenyl-2-trifluoromethyl-pent...)
Show SMILES CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C21H20F3NO4/c1-19(2,14-6-4-3-5-7-14)12-20(28,21(22,23)24)18(27)25-15-8-9-16-13(10-15)11-29-17(16)26/h3-10,28H,11-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a 150n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration against inhibition of Dexamethasone induced glucocorticoid receptor transactivation of mouse mammary tumor virus luciferase g...

Bioorg Med Chem Lett 15: 4761-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.025
BindingDB Entry DOI: 10.7270/Q24T6K5P
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%