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Compile Data Set for Download or QSAR

Found 43 hits of ec50 for UniProtKB: P62508   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM20608
PNG
(4-Hydroxytamoxifen | 4-Hydroxytamoxifen (9) | 4-[(...)
Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1)c1ccccc1
Show InChI InChI=1S/C26H29NO2/c1-4-25(20-8-6-5-7-9-20)26(21-10-14-23(28)15-11-21)22-12-16-24(17-13-22)29-19-18-27(2)3/h5-17,28H,4,18-19H2,1-3H3/b26-25-
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n/an/an/an/a 15n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455403
PNG
(CHEMBL4204173)
Show SMILES CC(C)(C)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C18H20N2O2/c1-18(2,3)15-8-4-13(5-9-15)12-19-20-17(22)14-6-10-16(21)11-7-14/h4-12,21H,1-3H3,(H,20,22)/b19-12+
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n/an/an/an/a 84n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22439
PNG
(GSK 9089 | GSK9089 | N'-[(1E)-[4-(diethylamino)phe...)
Show SMILES CCN(CC)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C18H21N3O2/c1-3-21(4-2)16-9-5-14(6-10-16)13-19-20-18(23)15-7-11-17(22)12-8-15/h5-13,22H,3-4H2,1-2H3,(H,20,23)/b19-13+
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n/an/an/an/a 130n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455418
PNG
(CHEMBL4204610)
Show SMILES CCN(CC(C)C)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C21H28N2O2/c1-4-23(15-16(2)3)19-9-5-17(6-10-19)13-14-22-21(25)18-7-11-20(24)12-8-18/h5-12,16,24H,4,13-15H2,1-3H3,(H,22,25)
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n/an/an/an/a 210n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455417
PNG
(CHEMBL4211016)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2N)cc1
Show InChI InChI=1S/C19H24N2O2/c1-19(2,3)14-6-4-13(5-7-14)10-11-21-18(23)16-9-8-15(22)12-17(16)20/h4-9,12,22H,10-11,20H2,1-3H3,(H,21,23)
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n/an/an/an/a 300n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455428
PNG
(CHEMBL4205664)
Show SMILES CCN(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C19H24N2O2/c1-3-21(4-2)17-9-5-15(6-10-17)13-14-20-19(23)16-7-11-18(22)12-8-16/h5-12,22H,3-4,13-14H2,1-2H3,(H,20,23)
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n/an/an/an/a 390n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22445
PNG
(Acyl Hydrazone, 10 | N'-[(1E)-1-[4-(diethylamino)p...)
Show SMILES CCN(CC)c1ccc(cc1)C(C)=NNC(=O)c1ccc(O)cc1 |w:13.14|
Show InChI InChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-15(7-11-17)14(3)20-21-19(24)16-8-12-18(23)13-9-16/h6-13,23H,4-5H2,1-3H3,(H,21,24)
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n/an/an/an/a 500n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22438
PNG
(4-Hydroxy-benzoic acid (4-isopropyl-benzylidene)-h...)
Show SMILES CC(C)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H18N2O2/c1-12(2)14-5-3-13(4-6-14)11-18-19-17(21)15-7-9-16(20)10-8-15/h3-12,20H,1-2H3,(H,19,21)/b18-11+
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n/an/an/an/a 600n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22443
PNG
(4-amino-N'-[(1E)-[4-(diethylamino)phenyl]methylide...)
Show SMILES CCN(CC)c1ccc(\C=N\NC(=O)c2ccc(N)cc2)cc1
Show InChI InChI=1S/C18H22N4O/c1-3-22(4-2)17-11-5-14(6-12-17)13-20-21-18(23)15-7-9-16(19)10-8-15/h5-13H,3-4,19H2,1-2H3,(H,21,23)/b20-13+
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n/an/an/an/a 630n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM20625
PNG
(4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol | ...)
Show SMILES CC\C(=C(\CC)c1ccc(O)cc1)c1ccc(O)cc1
Show InChI InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+
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n/an/an/an/a 630n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455402
PNG
(CHEMBL4204689)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C19H23NO2/c1-19(2,3)16-8-4-14(5-9-16)12-13-20-18(22)15-6-10-17(21)11-7-15/h4-11,21H,12-13H2,1-3H3,(H,20,22)
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n/an/an/an/a 700n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455427
PNG
(CHEMBL4206963)
Show SMILES Cc1cc(O)ccc1C(=O)NCCc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C20H25NO2/c1-14-13-17(22)9-10-18(14)19(23)21-12-11-15-5-7-16(8-6-15)20(2,3)4/h5-10,13,22H,11-12H2,1-4H3,(H,21,23)
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n/an/an/an/a 760n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455430
PNG
(CHEMBL4204153)
Show SMILES CC(C)(C)c1ccc(\C=N\NC(=O)c2ccc(O)c(O)c2)cc1
Show InChI InChI=1S/C18H20N2O3/c1-18(2,3)14-7-4-12(5-8-14)11-19-20-17(23)13-6-9-15(21)16(22)10-13/h4-11,21-22H,1-3H3,(H,20,23)/b19-11+
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n/an/an/an/a 810n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455404
PNG
(CHEMBL4207558)
Show SMILES CC(C)(C)c1ccc(\C=N\NC(=O)c2cccc(O)c2)cc1
Show InChI InChI=1S/C18H20N2O2/c1-18(2,3)15-9-7-13(8-10-15)12-19-20-17(22)14-5-4-6-16(21)11-14/h4-12,21H,1-3H3,(H,20,22)/b19-12+
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n/an/an/an/a 820n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455420
PNG
(CHEMBL4217033)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2Cl)cc1
Show InChI InChI=1S/C19H22ClNO2/c1-19(2,3)14-6-4-13(5-7-14)10-11-21-18(23)16-9-8-15(22)12-17(16)20/h4-9,12,22H,10-11H2,1-3H3,(H,21,23)
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n/an/an/an/a 950n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455406
PNG
(CHEMBL4211789)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C20H25NO2/c1-20(2,3)17-8-4-15(5-9-17)12-13-21-19(23)14-16-6-10-18(22)11-7-16/h4-11,22H,12-14H2,1-3H3,(H,21,23)
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n/an/an/an/a 950n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455412
PNG
(CHEMBL4209406)
Show SMILES CCCN(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C20H26N2O2/c1-3-15-22(4-2)18-9-5-16(6-10-18)13-14-21-20(24)17-7-11-19(23)12-8-17/h5-12,23H,3-4,13-15H2,1-2H3,(H,21,24)
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n/an/an/an/a 1.14E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22438
PNG
(4-Hydroxy-benzoic acid (4-isopropyl-benzylidene)-h...)
Show SMILES CC(C)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H18N2O2/c1-12(2)14-5-3-13(4-6-14)11-18-19-17(21)15-7-9-16(20)10-8-15/h3-12,20H,1-2H3,(H,19,21)/b18-11+
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n/an/an/an/a 1.30E+3n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455411
PNG
(CHEMBL4210295)
Show SMILES CCN(CC)c1ccc2cc(NC(=O)c3ccc(O)cc3)ccc2c1
Show InChI InChI=1S/C21H22N2O2/c1-3-23(4-2)19-10-6-16-13-18(9-5-17(16)14-19)22-21(25)15-7-11-20(24)12-8-15/h5-14,24H,3-4H2,1-2H3,(H,22,25)
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n/an/an/an/a 1.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22442
PNG
(Acyl Hydrazone, 7 | N'-[(1E)-[4-(diethylamino)phen...)
Show SMILES CCN(CC)c1ccc(\C=N\NC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C18H21N3O/c1-3-21(4-2)17-12-10-15(11-13-17)14-19-20-18(22)16-8-6-5-7-9-16/h5-14H,3-4H2,1-2H3,(H,20,22)/b19-14+
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n/an/an/an/a 1.60E+3n/an/a7.022



GSK



Assay Description
Recruitment of the RIP140 NR-box peptide to the ERRgamma ligand binding domain was assayed by FRET detection. Proteins were set up in a one to one ra...

J Med Chem 48: 3107-9 (2005)


Article DOI: 10.1021/jm050161j
BindingDB Entry DOI: 10.7270/Q2S46Q77
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455431
PNG
(CHEMBL4209143)
Show SMILES CCN(Cc1ccccc1)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H26N2O2/c1-2-26(18-20-6-4-3-5-7-20)22-12-8-19(9-13-22)16-17-25-24(28)21-10-14-23(27)15-11-21/h3-15,27H,2,16-18H2,1H3,(H,25,28)
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n/an/an/an/a 1.71E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM22438
PNG
(4-Hydroxy-benzoic acid (4-isopropyl-benzylidene)-h...)
Show SMILES CC(C)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H18N2O2/c1-12(2)14-5-3-13(4-6-14)11-18-19-17(21)15-7-9-16(20)10-8-15/h3-12,20H,1-2H3,(H,19,21)/b18-11+
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n/an/an/an/a 1.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Gal4 fused ERRgamma-LBD (unknown origin) expressed in HEK293T cells after 20 hrs by UAS-luciferase reporter gene assay

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455424
PNG
(CHEMBL4208749)
Show SMILES Oc1ccc(cc1)C(=O)N\N=C\c1ccc2ccccc2c1
Show InChI InChI=1S/C18H14N2O2/c21-17-9-7-15(8-10-17)18(22)20-19-12-13-5-6-14-3-1-2-4-16(14)11-13/h1-12,21H,(H,20,22)/b19-12+
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n/an/an/an/a 2.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455457
PNG
(CHEMBL4217256)
Show SMILES CN(C)c1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C16H17N3O2/c1-19(2)14-7-3-12(4-8-14)11-17-18-16(21)13-5-9-15(20)10-6-13/h3-11,20H,1-2H3,(H,18,21)/b17-11+
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n/an/an/an/a 2.15E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455405
PNG
(CHEMBL4203030)
Show SMILES C\C(=N/NC(=O)c1ccc(O)cc1)c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C19H22N2O2/c1-13(14-5-9-16(10-6-14)19(2,3)4)20-21-18(23)15-7-11-17(22)12-8-15/h5-12,22H,1-4H3,(H,21,23)/b20-13+
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n/an/an/an/a 2.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455419
PNG
(CHEMBL4211613)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccccc2O)cc1
Show InChI InChI=1S/C19H23NO2/c1-19(2,3)15-10-8-14(9-11-15)12-13-20-18(22)16-6-4-5-7-17(16)21/h4-11,21H,12-13H2,1-3H3,(H,20,22)
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n/an/an/an/a 2.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inverse agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455422
PNG
(CHEMBL4216299)
Show SMILES CCCN(CCC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C21H28N2O2/c1-3-15-23(16-4-2)19-9-5-17(6-10-19)13-14-22-21(25)18-7-11-20(24)12-8-18/h5-12,24H,3-4,13-16H2,1-2H3,(H,22,25)
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n/an/an/an/a 3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455432
PNG
(CHEMBL4216886)
Show SMILES CC(=O)Nc1ccc(cc1)C(=O)N\N=C\c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C20H23N3O2/c1-14(24)22-18-11-7-16(8-12-18)19(25)23-21-13-15-5-9-17(10-6-15)20(2,3)4/h5-13H,1-4H3,(H,22,24)(H,23,25)/b21-13+
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n/an/an/an/a 3.10E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455421
PNG
(CHEMBL4205820)
Show SMILES CN(CCc1ccc(cc1)C(C)(C)C)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C20H25NO2/c1-20(2,3)17-9-5-15(6-10-17)13-14-21(4)19(23)16-7-11-18(22)12-8-16/h5-12,22H,13-14H2,1-4H3
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n/an/an/an/a 3.20E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455413
PNG
(CHEMBL4208949)
Show SMILES CCC(C)N(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C21H28N2O2/c1-4-16(3)23(5-2)19-10-6-17(7-11-19)14-15-22-21(25)18-8-12-20(24)13-9-18/h6-13,16,24H,4-5,14-15H2,1-3H3,(H,22,25)
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n/an/an/an/a 3.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455429
PNG
(CHEMBL4217743)
Show SMILES CCN(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1Br
Show InChI InChI=1S/C19H23BrN2O2/c1-3-22(4-2)18-10-5-14(13-17(18)20)11-12-21-19(24)15-6-8-16(23)9-7-15/h5-10,13,23H,3-4,11-12H2,1-2H3,(H,21,24)
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n/an/an/an/a 4.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455426
PNG
(CHEMBL4218028)
Show SMILES CC(C)(C)c1ccc(CCCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C20H25NO2/c1-20(2,3)17-10-6-15(7-11-17)5-4-14-21-19(23)16-8-12-18(22)13-9-16/h6-13,22H,4-5,14H2,1-3H3,(H,21,23)
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n/an/an/an/a 4.40E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455402
PNG
(CHEMBL4204689)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C19H23NO2/c1-19(2,3)16-8-4-14(5-9-16)12-13-20-18(22)15-6-10-17(21)11-7-15/h4-11,21H,12-13H2,1-3H3,(H,20,22)
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n/an/an/an/a 4.70E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Gal4 fused ERRgamma-LBD (unknown origin) expressed in HEK293T cells after 20 hrs by UAS-luciferase reporter gene assay

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455410
PNG
(CHEMBL4202808)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2C(F)(F)F)cc1
Show InChI InChI=1S/C20H22F3NO2/c1-19(2,3)14-6-4-13(5-7-14)10-11-24-18(26)16-9-8-15(25)12-17(16)20(21,22)23/h4-9,12,25H,10-11H2,1-3H3,(H,24,26)
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n/an/an/an/a 5.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455414
PNG
(CHEMBL4212795)
Show SMILES CCN(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1Cl
Show InChI InChI=1S/C19H23ClN2O2/c1-3-22(4-2)18-10-5-14(13-17(18)20)11-12-21-19(24)15-6-8-16(23)9-7-15/h5-10,13,23H,3-4,11-12H2,1-2H3,(H,21,24)
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n/an/an/an/a 5.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455423
PNG
(CHEMBL4211906)
Show SMILES CC(C)(C)c1ccc(\C=N\NC(=O)c2ccc(cc2)C(N)=O)cc1
Show InChI InChI=1S/C19H21N3O2/c1-19(2,3)16-10-4-13(5-11-16)12-21-22-18(24)15-8-6-14(7-9-15)17(20)23/h4-12H,1-3H3,(H2,20,23)(H,22,24)/b21-12+
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n/an/an/an/a 6.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455407
PNG
(CHEMBL4211333)
Show SMILES Cc1cc(ccc1O)C(=O)NCCc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C20H25NO2/c1-14-13-16(7-10-18(14)22)19(23)21-12-11-15-5-8-17(9-6-15)20(2,3)4/h5-10,13,22H,11-12H2,1-4H3,(H,21,23)
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n/an/an/an/a 6.20E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455415
PNG
(CHEMBL4206319)
Show SMILES CC(C)(C)c1ccc(CNNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C18H22N2O2/c1-18(2,3)15-8-4-13(5-9-15)12-19-20-17(22)14-6-10-16(21)11-7-14/h4-11,19,21H,12H2,1-3H3,(H,20,22)
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n/an/an/an/a 6.20E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455408
PNG
(CHEMBL4206438)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)c(F)c2)cc1
Show InChI InChI=1S/C19H22FNO2/c1-19(2,3)15-7-4-13(5-8-15)10-11-21-18(23)14-6-9-17(22)16(20)12-14/h4-9,12,22H,10-11H2,1-3H3,(H,21,23)
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n/an/an/an/a 7.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455425
PNG
(CHEMBL4213990)
Show SMILES CC(C)(C)c1ccc(\C=N\NC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C18H20N2O/c1-18(2,3)16-11-9-14(10-12-16)13-19-20-17(21)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,20,21)/b19-13+
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n/an/an/an/a 7.60E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455416
PNG
(CHEMBL4206727)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C19H23NO/c1-19(2,3)17-11-9-15(10-12-17)13-14-20-18(21)16-7-5-4-6-8-16/h4-12H,13-14H2,1-3H3,(H,20,21)
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n/an/an/an/a 7.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Partial agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) ce...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455409
PNG
(CHEMBL4207869)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(O)cc2F)cc1
Show InChI InChI=1S/C19H22FNO2/c1-19(2,3)14-6-4-13(5-7-14)10-11-21-18(23)16-9-8-15(22)12-17(16)20/h4-9,12,22H,10-11H2,1-3H3,(H,21,23)
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n/an/an/an/a 8.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair
Estrogen-related receptor gamma


(Homo sapiens (Human))		BDBM50455456
PNG
(CHEMBL4212497)
Show SMILES CC(C)(C)c1ccc(CCNC(=O)c2ccc(N)cc2)cc1
Show InChI InChI=1S/C19H24N2O/c1-19(2,3)16-8-4-14(5-9-16)12-13-21-18(22)15-6-10-17(20)11-7-15/h4-11H,12-13,20H2,1-3H3,(H,21,22)
PDB
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n/an/an/an/a 9.10E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...

Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair