Compile Data Set for Download or QSAR

Found 1219 hits of ic50 for UniProtKB: P08235   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM19214 ((1S,2R,10S,11S,14S,15R,17S)-17-hydroxy-14-(2-hydro...) Show SMILES [H][C@@]12CC[C@H](C(=O)CO)[C@]1(C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C)C=O |t:21| Show InChI InChI=1S/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	0.305	n/a	n/a	n/a	n/a	n/a	n/a
Marquette University Curated by ChEMBL					Assay Description Agonist activity at GAL4 DNA-binding domain fused MR (unknown origin) ligand binding domain expressed in UAS-bla H cells assessed as beta-lactamase t...				Eur J Med Chem 157: 791-804 (2018) Article DOI: 10.1016/j.ejmech.2018.08.006 BindingDB Entry DOI: 10.7270/Q2K64MS7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50531563 (CHEMBL4463240) Show SMILES CC(C)Cc1cc2N([C@@H](CS(N)(=O)=O)COc2cc1F)C(=O)c1ccc2OCC(=O)Nc2c1 |r| Show InChI InChI=1S/C22H24FN3O6S/c1-12(2)5-14-7-18-20(8-16(14)23)31-9-15(11-33(24,29)30)26(18)22(28)13-3-4-19-17(6-13)25-21(27)10-32-19/h3-4,6-8,12,15H,5,9-11H2,1-2H3,(H,25,27)(H2,24,29,30)/t15-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.794	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co., Ltd Curated by ChEMBL					Assay Description Antagonist activity at gal4-fused human mineralocorticoid receptor LBD expressed in UAS-MR-bla HEK293 cells by luciferase reporter gene assay				J Med Chem 62: 1385-1406 (2019) Article DOI: 10.1021/acs.jmedchem.8b01523 BindingDB Entry DOI: 10.7270/Q2GT5RP6
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235931 (CHEMBL4087205) Show SMILES C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1-c1ccc(F)cc1 |r,wU:1.0,(29.96,-24.22,;31.49,-24.07,;32.39,-25.31,;32.12,-22.66,;31.21,-21.41,;29.67,-21.41,;29.2,-19.95,;27.74,-19.47,;27.42,-17.97,;26.59,-20.5,;25.13,-20.03,;24.82,-18.52,;23.35,-18.04,;22.21,-19.08,;22.53,-20.59,;24,-21.06,;20.74,-18.6,;19.6,-19.64,;19.96,-17.26,;21.51,-17.25,;30.44,-19.04,;30.44,-17.5,;31.69,-19.95,;33.16,-19.47,;34.29,-20.51,;35.76,-20.03,;36.08,-18.53,;37.55,-18.05,;34.93,-17.49,;33.47,-17.97,;32.32,-16.95,;32.64,-15.44,;31.5,-14.42,;30.03,-14.9,;28.88,-13.87,;29.72,-16.42,;30.87,-17.43,)| Show InChI InChI=1S/C28H26ClFN2O4S/c1-17(33)14-23-16-25(28(34)31-22-9-11-24(12-10-22)37(3,35)36)18(2)32(23)27-13-6-20(29)15-26(27)19-4-7-21(30)8-5-19/h4-13,15-17,33H,14H2,1-3H3,(H,31,34)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235931 (CHEMBL4087205) Show SMILES C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1-c1ccc(F)cc1 |r,wU:1.0,(29.96,-24.22,;31.49,-24.07,;32.39,-25.31,;32.12,-22.66,;31.21,-21.41,;29.67,-21.41,;29.2,-19.95,;27.74,-19.47,;27.42,-17.97,;26.59,-20.5,;25.13,-20.03,;24.82,-18.52,;23.35,-18.04,;22.21,-19.08,;22.53,-20.59,;24,-21.06,;20.74,-18.6,;19.6,-19.64,;19.96,-17.26,;21.51,-17.25,;30.44,-19.04,;30.44,-17.5,;31.69,-19.95,;33.16,-19.47,;34.29,-20.51,;35.76,-20.03,;36.08,-18.53,;37.55,-18.05,;34.93,-17.49,;33.47,-17.97,;32.32,-16.95,;32.64,-15.44,;31.5,-14.42,;30.03,-14.9,;28.88,-13.87,;29.72,-16.42,;30.87,-17.43,)| Show InChI InChI=1S/C28H26ClFN2O4S/c1-17(33)14-23-16-25(28(34)31-22-9-11-24(12-10-22)37(3,35)36)18(2)32(23)27-13-6-20(29)15-26(27)19-4-7-21(30)8-5-19/h4-13,15-17,33H,14H2,1-3H3,(H,31,34)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50172022 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Schering Pharma AG Curated by ChEMBL					Assay Description Binding affinity to human recombinant mineralocorticoid receptor expressed in baculovirus infected Sf9 cells				Bioorg Med Chem Lett 20: 5835-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.125 BindingDB Entry DOI: 10.7270/Q26974V3
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235961 (CHEMBL4102708) Show SMILES CC(=O)Oc1ccc(CCc2cc(C)c3OCC(=O)Nc3c2)c(C)c1 Show InChI InChI=1S/C20H21NO4/c1-12-9-17(25-14(3)22)7-6-16(12)5-4-15-8-13(2)20-18(10-15)21-19(23)11-24-20/h6-10H,4-5,11H2,1-3H3,(H,21,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Inhibition of rat liver KYN 3-OHase.				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50228080 (2',15'-dimethyl-5,5'-dioxo-(9'R)-spiro[tetrahydrof...) Show SMILES CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]33CCC(=O)O3)[C@H]12 |r,t:6| Show InChI InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor ligand binding domain expressed in african green monkey COS7 cells co-transfected with Gal4-LBD by ...				J Nat Prod 72: 1944-8 (2009) Article DOI: 10.1021/np9004882 BindingDB Entry DOI: 10.7270/Q2R49RQR
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013412 (CHEMBL3263752) Show SMILES COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12| Show InChI InChI=1S/C23H24N4O3/c1-14-11-17(8-7-16(14)13-24)27-21(15-5-3-4-6-15)12-20(26-27)19-10-9-18(23(28)29)22(25-19)30-2/h7-11,15,21H,3-6,12H2,1-2H3,(H,28,29)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to mineralocorticoid receptor (unknown origin)				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235960 (CHEMBL4078451) Show SMILES CC(=O)Oc1ccc(CCc2ccc3OCC(=O)Nc3c2)c(C)c1 Show InChI InChI=1S/C19H19NO4/c1-12-9-16(24-13(2)21)7-6-15(12)5-3-14-4-8-18-17(10-14)20-19(22)11-23-18/h4,6-10H,3,5,11H2,1-2H3,(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	<2	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (672 to 984 residues) expressed in HEK293T cells assessed as inhibition of aldosterone-induced transac...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324200 (4-[(5R)-1-(3-Chloro-4-cyanophenyl)-5-cyclopentyl-4...) Show SMILES COc1cc(ccc1C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1)C(O)=O |r,t:9| Show InChI InChI=1S/C23H22ClN3O3/c1-30-22-10-15(23(28)29)7-9-18(22)20-12-21(14-4-2-3-5-14)27(26-20)17-8-6-16(13-25)19(24)11-17/h6-11,14,21H,2-5,12H2,1H3,(H,28,29)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at Gal4-tagged mineralocorticoid receptor expressed in human Huh7 cells by luciferase reporter gene assay				J Med Chem 53: 5979-6002 (2010) Article DOI: 10.1021/jm100505n BindingDB Entry DOI: 10.7270/Q2T43V2T
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013430 (CHEMBL3263768) Show SMILES COc1nc(ccc1C(=O)Nc1nnn[nH]1)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:18| Show InChI InChI=1S/C24H25N9O2/c1-14-11-17(8-7-16(14)13-25)33-21(15-5-3-4-6-15)12-20(30-33)19-10-9-18(23(26-19)35-2)22(34)27-24-28-31-32-29-24/h7-11,15,21H,3-6,12H2,1-2H3,(H2,27,28,29,31,32,34)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50398059 (CHEMBL2181932) Show SMILES Cc1c(cn(CCO)c1-c1ccccc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(34.95,-31.12,;34.48,-32.58,;33,-33.06,;33.01,-34.59,;34.47,-35.07,;34.85,-36.57,;33.75,-37.64,;34.13,-39.14,;35.38,-33.82,;36.92,-33.83,;37.69,-32.5,;39.22,-32.5,;40,-33.83,;39.22,-35.17,;37.68,-35.17,;36.92,-36.49,;35.38,-36.49,;37.68,-37.83,;36.13,-37.83,;31.76,-32.15,;31.76,-30.61,;30.43,-32.92,;29.09,-32.16,;27.76,-32.93,;26.42,-32.16,;26.42,-30.61,;27.75,-29.84,;29.08,-30.6,;25.09,-29.84,;25.08,-28.3,;24.31,-31.17,;23.55,-29.84,)| Show InChI InChI=1S/C22H21F3N2O4S/c1-14-18(21(29)26-15-7-9-16(10-8-15)32(2,30)31)13-27(11-12-28)20(14)17-5-3-4-6-19(17)22(23,24)25/h3-10,13,28H,11-12H2,1-2H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor				J Med Chem 55: 7957-66 (2012) Article DOI: 10.1021/jm300806c BindingDB Entry DOI: 10.7270/Q2QC04N3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50531598 (CHEMBL4572476) Show SMILES CS(=O)(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r| Show InChI InChI=1S/C19H17FN2O6S/c1-29(25,26)10-13-8-27-17-7-12(20)3-4-15(17)22(13)19(24)11-2-5-16-14(6-11)21-18(23)9-28-16/h2-7,13H,8-10H2,1H3,(H,21,23)/t13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co., Ltd Curated by ChEMBL					Assay Description Antagonist activity at gal4-fused human mineralocorticoid receptor LBD expressed in UAS-MR-bla HEK293 cells by luciferase reporter gene assay				J Med Chem 62: 1385-1406 (2019) Article DOI: 10.1021/acs.jmedchem.8b01523 BindingDB Entry DOI: 10.7270/Q2GT5RP6
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50531587 (CHEMBL4471322) Show SMILES CC(C)Cc1cc2N([C@@H](CC(N)=O)COc2cc1Cl)C(=O)c1ccc2OCC(=O)Nc2c1 |r| Show InChI InChI=1S/C23H24ClN3O5/c1-12(2)5-14-7-18-20(9-16(14)24)31-10-15(8-21(25)28)27(18)23(30)13-3-4-19-17(6-13)26-22(29)11-32-19/h3-4,6-7,9,12,15H,5,8,10-11H2,1-2H3,(H2,25,28)(H,26,29)/t15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co., Ltd Curated by ChEMBL					Assay Description Antagonist activity at gal4-fused human mineralocorticoid receptor LBD expressed in UAS-MR-bla HEK293 cells by luciferase reporter gene assay				J Med Chem 62: 1385-1406 (2019) Article DOI: 10.1021/acs.jmedchem.8b01523 BindingDB Entry DOI: 10.7270/Q2GT5RP6
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013422 (CHEMBL3263760) Show SMILES COc1nc(ccc1C(N)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12| Show InChI InChI=1S/C23H25N5O2/c1-14-11-17(8-7-16(14)13-24)28-21(15-5-3-4-6-15)12-20(27-28)19-10-9-18(22(25)29)23(26-19)30-2/h7-11,15,21H,3-6,12H2,1-2H3,(H2,25,29)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013428 (CHEMBL3263766) Show SMILES COc1nc(ccc1C(=O)NS(C)(=O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:16| Show InChI InChI=1S/C24H27N5O4S/c1-15-12-18(9-8-17(15)14-25)29-22(16-6-4-5-7-16)13-21(27-29)20-11-10-19(24(26-20)33-2)23(30)28-34(3,31)32/h8-12,16,22H,4-7,13H2,1-3H3,(H,28,30)/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235932 (CHEMBL4065788) Show SMILES C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1C(F)(F)F |r,wU:1.0,(10.44,-22.82,;11.97,-22.66,;12.88,-23.9,;12.6,-21.25,;11.7,-20,;10.16,-20,;9.69,-18.54,;8.22,-18.07,;7.9,-16.56,;7.08,-19.1,;5.61,-18.62,;5.3,-17.11,;3.84,-16.64,;2.69,-17.67,;3.02,-19.18,;4.48,-19.65,;1.22,-17.19,;.08,-18.23,;.44,-15.85,;1.99,-15.85,;10.93,-17.63,;10.93,-16.09,;12.18,-18.54,;13.64,-18.07,;14.78,-19.1,;16.24,-18.63,;16.57,-17.12,;18.03,-16.64,;15.41,-16.09,;13.95,-16.56,;12.81,-15.54,;13.12,-14.03,;11.34,-16.02,;11.71,-14.44,)| Show InChI InChI=1S/C23H22ClF3N2O4S/c1-13(30)10-17-12-19(22(31)28-16-5-7-18(8-6-16)34(3,32)33)14(2)29(17)21-9-4-15(24)11-20(21)23(25,26)27/h4-9,11-13,30H,10H2,1-3H3,(H,28,31)/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235932 (CHEMBL4065788) Show SMILES C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1C(F)(F)F |r,wU:1.0,(10.44,-22.82,;11.97,-22.66,;12.88,-23.9,;12.6,-21.25,;11.7,-20,;10.16,-20,;9.69,-18.54,;8.22,-18.07,;7.9,-16.56,;7.08,-19.1,;5.61,-18.62,;5.3,-17.11,;3.84,-16.64,;2.69,-17.67,;3.02,-19.18,;4.48,-19.65,;1.22,-17.19,;.08,-18.23,;.44,-15.85,;1.99,-15.85,;10.93,-17.63,;10.93,-16.09,;12.18,-18.54,;13.64,-18.07,;14.78,-19.1,;16.24,-18.63,;16.57,-17.12,;18.03,-16.64,;15.41,-16.09,;13.95,-16.56,;12.81,-15.54,;13.12,-14.03,;11.34,-16.02,;11.71,-14.44,)| Show InChI InChI=1S/C23H22ClF3N2O4S/c1-13(30)10-17-12-19(22(31)28-16-5-7-18(8-6-16)34(3,32)33)14(2)29(17)21-9-4-15(24)11-20(21)23(25,26)27/h4-9,11-13,30H,10H2,1-3H3,(H,28,31)/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM150275 (US8987239, A | US9034856, A) Show SMILES C[C@]12CC[C@H]3[C@@H]([C@H]4C[C@H]4C4=CC(=O)CC[C@]34C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 |r,t:10| Show InChI InChI=1S/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3/t13-,14+,15-,16+,18+,20-,21+,22-,23+,24+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid UniChem Similars	DrugBank US Patent	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Intellectual Property GmbH US Patent					Assay Description Using cytosol from progesterone receptor-expressing insect cells (Hi5), competitive binding to the progesterone receptor was determined from the abil...				US Patent US9034856 (2015) BindingDB Entry DOI: 10.7270/Q2MP5218
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013426 (CHEMBL3263764) Show SMILES CNC(=O)c1ccc(nc1OC)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:13| Show InChI InChI=1S/C23H26N6O2/c1-14-16(13-24)8-11-21(26-14)29-20(15-6-4-5-7-15)12-19(28-29)18-10-9-17(22(30)25-2)23(27-18)31-3/h8-11,15,20H,4-7,12H2,1-3H3,(H,25,30)/t20-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235959 (CHEMBL4064750) Show SMILES Cc1c(cc(CCO)n1-c1ccc(Cl)cc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(72.44,-4.78,;72.44,-6.32,;71.2,-7.22,;71.67,-8.69,;73.21,-8.69,;74.12,-9.93,;73.49,-11.34,;74.39,-12.59,;73.69,-7.22,;75.16,-6.75,;76.29,-7.78,;77.76,-7.31,;78.08,-5.8,;79.55,-5.33,;76.93,-4.77,;75.47,-5.25,;74.32,-4.22,;74.64,-2.71,;72.86,-4.7,;73.22,-3.12,;69.74,-6.75,;69.42,-5.24,;68.59,-7.78,;67.13,-7.3,;66.82,-5.8,;65.35,-5.32,;64.21,-6.35,;64.54,-7.86,;66,-8.33,;62.74,-5.87,;61.6,-6.91,;61.96,-4.53,;63.51,-4.53,)| Show InChI InChI=1S/C22H20ClF3N2O4S/c1-13-18(21(30)27-15-4-6-17(7-5-15)33(2,31)32)12-16(9-10-29)28(13)20-8-3-14(23)11-19(20)22(24,25)26/h3-8,11-12,29H,9-10H2,1-2H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Stimulation of cAMP in CHO cells expressing human m2 receptor				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013424 (CHEMBL3263762) Show SMILES COc1nc(ccc1C(=O)N(C)C)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:14| Show InChI InChI=1S/C25H29N5O2/c1-16-13-19(10-9-18(16)15-26)30-23(17-7-5-6-8-17)14-22(28-30)21-12-11-20(24(27-21)32-4)25(31)29(2)3/h9-13,17,23H,5-8,14H2,1-4H3/t23-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50318295 (CHEMBL1097751 | tert-Butyl (4R)-4-(2-Chloro-4-fluo...) Show SMILES CC1=NC(C)=C([C@@H](C1C#N)c1ccc(F)cc1Cl)C(=O)OC(C)(C)C |r,c:4,t:1| Show InChI InChI=1S/C19H20ClFN2O2/c1-10-14(9-22)17(13-7-6-12(21)8-15(13)20)16(11(2)23-10)18(24)25-19(3,4)5/h6-8,14,17H,1-5H3/t14?,17-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research& Development Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused mineralocorticoid receptor expressed in human HuH7 cells assessed as inhibition of aldosterone-induced receptor act...				J Med Chem 53: 4300-4 (2010) Article DOI: 10.1021/jm1002827 BindingDB Entry DOI: 10.7270/Q22R3RV8
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235959 (CHEMBL4064750) Show SMILES Cc1c(cc(CCO)n1-c1ccc(Cl)cc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(72.44,-4.78,;72.44,-6.32,;71.2,-7.22,;71.67,-8.69,;73.21,-8.69,;74.12,-9.93,;73.49,-11.34,;74.39,-12.59,;73.69,-7.22,;75.16,-6.75,;76.29,-7.78,;77.76,-7.31,;78.08,-5.8,;79.55,-5.33,;76.93,-4.77,;75.47,-5.25,;74.32,-4.22,;74.64,-2.71,;72.86,-4.7,;73.22,-3.12,;69.74,-6.75,;69.42,-5.24,;68.59,-7.78,;67.13,-7.3,;66.82,-5.8,;65.35,-5.32,;64.21,-6.35,;64.54,-7.86,;66,-8.33,;62.74,-5.87,;61.6,-6.91,;61.96,-4.53,;63.51,-4.53,)| Show InChI InChI=1S/C22H20ClF3N2O4S/c1-13-18(21(30)27-15-4-6-17(7-5-15)33(2,31)32)12-16(9-10-29)28(13)20-8-3-14(23)11-19(20)22(24,25)26/h3-8,11-12,29H,9-10H2,1-2H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235944 (CHEMBL4078631) Show SMILES C[C@H](O)[C@@H](C)n1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)c1-c1ccc(F)cc1C(F)(F)F |r,wU:1.0,wD:3.3,(67.48,-25.05,;69.02,-24.89,;69.92,-26.14,;69.64,-23.48,;71.18,-23.32,;68.74,-22.24,;67.2,-22.24,;66.73,-20.77,;65.26,-20.3,;64.94,-18.79,;64.12,-21.33,;62.66,-20.85,;62.34,-19.34,;60.88,-18.87,;59.74,-19.9,;60.06,-21.41,;61.53,-21.88,;58.26,-19.42,;57.13,-20.46,;57.49,-18.08,;59.03,-18.08,;67.97,-19.86,;67.97,-18.32,;69.22,-20.77,;70.69,-20.3,;71.82,-21.33,;73.29,-20.86,;73.61,-19.35,;75.07,-18.88,;72.46,-18.32,;71,-18.8,;69.85,-17.77,;70.16,-16.26,;68.39,-18.25,;68.75,-16.67,)| Show InChI InChI=1S/C24H24F4N2O4S/c1-13-20(23(32)29-17-6-8-18(9-7-17)35(4,33)34)12-30(14(2)15(3)31)22(13)19-10-5-16(25)11-21(19)24(26,27)28/h5-12,14-15,31H,1-4H3,(H,29,32)/t14-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Compound was tested in vitro for inhibition of tubulin polymerization.				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324215 ((+/-)-(3SR,3aRS)-2-(4-Cyano-3-methylphenyl)-3-cycl...) Show SMILES Cc1cc(ccc1C#N)N1N=C2[C@H](CCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:11| Show InChI InChI=1S/C25H25N3O2/c1-15-12-20(9-6-19(15)14-26)28-24(16-4-2-3-5-16)22-11-7-17-13-18(25(29)30)8-10-21(17)23(22)27-28/h6,8-10,12-13,16,22,24H,2-5,7,11H2,1H3,(H,29,30)/t22-,24-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at Gal4-tagged mineralocorticoid receptor expressed in human Huh7 cells by luciferase reporter gene assay				J Med Chem 53: 5979-6002 (2010) Article DOI: 10.1021/jm100505n BindingDB Entry DOI: 10.7270/Q2T43V2T
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013429 (CHEMBL3263767) Show SMILES COc1nc(ccc1C(=O)NS(C)(=O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:16| Show InChI InChI=1S/C23H26N6O4S/c1-14-16(13-24)8-11-21(25-14)29-20(15-6-4-5-7-15)12-19(27-29)18-10-9-17(23(26-18)33-2)22(30)28-34(3,31)32/h8-11,15,20H,4-7,12H2,1-3H3,(H,28,30)/t20-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013425 (CHEMBL3263763) Show SMILES COc1nc(ccc1C(N)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:12| Show InChI InChI=1S/C22H24N6O2/c1-13-15(12-23)7-10-20(25-13)28-19(14-5-3-4-6-14)11-18(27-28)17-9-8-16(21(24)29)22(26-17)30-2/h7-10,14,19H,3-6,11H2,1-2H3,(H2,24,29)/t19-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013419 (CHEMBL3263757) Show SMILES CCOc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:13| Show InChI InChI=1S/C24H26N4O3/c1-3-31-23-19(24(29)30)10-11-20(26-23)21-13-22(16-6-4-5-7-16)28(27-21)18-9-8-17(14-25)15(2)12-18/h8-12,16,22H,3-7,13H2,1-2H3,(H,29,30)/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013412 (CHEMBL3263752) Show SMILES COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12| Show InChI InChI=1S/C23H24N4O3/c1-14-11-17(8-7-16(14)13-24)27-21(15-5-3-4-6-15)12-20(26-27)19-10-9-18(23(28)29)22(25-19)30-2/h7-11,15,21H,3-6,12H2,1-2H3,(H,28,29)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM121444 (US8722709, 48) Show SMILES Cc1cc(F)ccc1CCc1ccnc(NC(N)=O)c1 Show InChI InChI=1S/C15H16FN3O/c1-10-8-13(16)5-4-12(10)3-2-11-6-7-18-14(9-11)19-15(17)20/h4-9H,2-3H2,1H3,(H3,17,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.70	n/a	n/a	n/a	n/a	7.4	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The MR competitive binding assay is based on the binding and displacement of a TAMRA-labeled Dexamethasone probe with fluorescence polarization (FP) ...				US Patent US8722709 (2014) BindingDB Entry DOI: 10.7270/Q2NS0SJ4
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM121444 (US8722709, 48) Show SMILES Cc1cc(F)ccc1CCc1ccnc(NC(N)=O)c1 Show InChI InChI=1S/C15H16FN3O/c1-10-8-13(16)5-4-12(10)3-2-11-6-7-18-14(9-11)19-15(17)20/h4-9H,2-3H2,1H3,(H3,17,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Displacement of TAMRA-labeled dexamethasone from full-length human mineralocorticoid receptor expressed in baculovirus infected insect cells after 60...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM158519 (US9034856, 7) Show SMILES CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]21OCC=C1 |r,c:26,t:9| Show InChI InChI=1S/C22H30O2/c1-2-21-11-8-18-17-7-5-16(23)14-15(17)4-6-19(18)20(21)9-12-22(21)10-3-13-24-22/h3,10,14,17-20H,2,4-9,11-13H2,1H3/t17-,18+,19+,20-,21-,22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Intellectual Property GmbH US Patent					Assay Description Using cytosol from progesterone receptor-expressing insect cells (Hi5), competitive binding to the progesterone receptor was determined from the abil...				US Patent US9034856 (2015) BindingDB Entry DOI: 10.7270/Q2MP5218
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324201 (4-[(5R)-1-(3-Chloro-4-cyanophenyl)-5-cyclopentyl-4...) Show SMILES CCOc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:13| Show InChI InChI=1S/C24H24ClN3O3/c1-2-31-23-11-16(8-10-19(23)24(29)30)21-13-22(15-5-3-4-6-15)28(27-21)18-9-7-17(14-26)20(25)12-18/h7-12,15,22H,2-6,13H2,1H3,(H,29,30)/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at Gal4-tagged mineralocorticoid receptor expressed in human Huh7 cells by luciferase reporter gene assay				J Med Chem 53: 5979-6002 (2010) Article DOI: 10.1021/jm100505n BindingDB Entry DOI: 10.7270/Q2T43V2T
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235965 (CHEMBL4088459) Show SMILES C[C@H](O)[C@@H](C)c1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(F)cc1C(F)(F)F |r,wU:1.0,wD:3.3,(68.05,-24.81,;69.58,-24.65,;70.49,-25.9,;70.21,-23.24,;71.74,-23.08,;69.31,-22,;67.77,-22,;67.3,-20.53,;65.83,-20.06,;65.51,-18.55,;64.69,-21.09,;63.22,-20.61,;62.91,-19.1,;61.45,-18.63,;60.3,-19.66,;60.63,-21.17,;62.09,-21.64,;58.83,-19.18,;57.69,-20.22,;58.05,-17.84,;59.6,-17.84,;68.54,-19.62,;68.54,-18.08,;69.79,-20.53,;71.25,-20.06,;72.39,-21.09,;73.85,-20.62,;74.18,-19.11,;75.64,-18.63,;73.02,-18.08,;71.56,-18.56,;70.42,-17.53,;70.73,-16.02,;68.95,-18.01,;69.32,-16.43,)| Show InChI InChI=1S/C24H24F4N2O4S/c1-13(15(3)31)22-12-19(23(32)29-17-6-8-18(9-7-17)35(4,33)34)14(2)30(22)21-10-5-16(25)11-20(21)24(26,27)28/h5-13,15,31H,1-4H3,(H,29,32)/t13-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.20	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235945 (CHEMBL4068898) Show SMILES Cc1c(cc(CCF)n1-c1ccc(F)cc1OC(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(49.68,-18.43,;49.68,-19.97,;48.44,-20.87,;48.91,-22.34,;50.45,-22.34,;51.35,-23.59,;50.72,-24.99,;51.63,-26.24,;50.93,-20.87,;52.39,-20.4,;53.53,-21.43,;54.99,-20.96,;55.32,-19.45,;56.78,-18.98,;54.16,-18.42,;52.7,-18.9,;51.56,-17.87,;51.87,-16.36,;50.72,-15.34,;53.33,-15.88,;46.97,-20.4,;46.65,-18.89,;45.83,-21.43,;44.36,-20.95,;44.05,-19.45,;42.59,-18.97,;41.44,-20,;41.77,-21.51,;43.23,-21.98,;39.97,-19.52,;38.83,-20.56,;39.19,-18.18,;40.74,-18.18,)| Show InChI InChI=1S/C22H20F4N2O4S/c1-13-18(21(29)27-15-4-6-17(7-5-15)33(2,30)31)12-16(9-10-23)28(13)19-8-3-14(24)11-20(19)32-22(25)26/h3-8,11-12,22H,9-10H2,1-2H3,(H,27,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description compound was evaluated for inhibition of rat liver KYN 3-OHase.				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235945 (CHEMBL4068898) Show SMILES Cc1c(cc(CCF)n1-c1ccc(F)cc1OC(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(49.68,-18.43,;49.68,-19.97,;48.44,-20.87,;48.91,-22.34,;50.45,-22.34,;51.35,-23.59,;50.72,-24.99,;51.63,-26.24,;50.93,-20.87,;52.39,-20.4,;53.53,-21.43,;54.99,-20.96,;55.32,-19.45,;56.78,-18.98,;54.16,-18.42,;52.7,-18.9,;51.56,-17.87,;51.87,-16.36,;50.72,-15.34,;53.33,-15.88,;46.97,-20.4,;46.65,-18.89,;45.83,-21.43,;44.36,-20.95,;44.05,-19.45,;42.59,-18.97,;41.44,-20,;41.77,-21.51,;43.23,-21.98,;39.97,-19.52,;38.83,-20.56,;39.19,-18.18,;40.74,-18.18,)| Show InChI InChI=1S/C22H20F4N2O4S/c1-13-18(21(29)27-15-4-6-17(7-5-15)33(2,30)31)12-16(9-10-23)28(13)19-8-3-14(24)11-20(19)32-22(25)26/h3-8,11-12,22H,9-10H2,1-2H3,(H,27,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (671 to 984 residues) expressed in African Green Monkey CV-1 cells assessed as inhibition of aldostero...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324216 ((+/-)-(3SR,3aRS)-2-(4-Cyano-3-methoxyphenyl)-3-cyc...) Show SMILES COc1cc(ccc1C#N)N1N=C2[C@H](CCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:12| Show InChI InChI=1S/C25H25N3O3/c1-31-22-13-19(9-6-18(22)14-26)28-24(15-4-2-3-5-15)21-11-7-16-12-17(25(29)30)8-10-20(16)23(21)27-28/h6,8-10,12-13,15,21,24H,2-5,7,11H2,1H3,(H,29,30)/t21-,24-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at Gal4-tagged mineralocorticoid receptor expressed in human Huh7 cells by luciferase reporter gene assay				J Med Chem 53: 5979-6002 (2010) Article DOI: 10.1021/jm100505n BindingDB Entry DOI: 10.7270/Q2T43V2T
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50235953 (CHEMBL4104632) Show SMILES CC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc2c1oc(C)cc2=O)C(=O)OC1CCC1 |r,c:3,8| Show InChI InChI=1S/C24H25NO5/c1-12-11-19(27)17-9-6-10-18(23(17)29-12)22-20(15(4)26)13(2)25-14(3)21(22)24(28)30-16-7-5-8-16/h6,9-11,16,22,25H,5,7-8H2,1-4H3/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Antagonist activity at Gal4-fused human MR LBD (734 to 985 residues) expressed in CHO-K1 cells after 5 to 6 hrs by luciferase reporter gene assay				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50398058 (CHEMBL2181933 | US8722709, 24) Show SMILES Cc1ccccc1CCc1ccnc(NC(N)=O)c1 Show InChI InChI=1S/C15H17N3O/c1-11-4-2-3-5-13(11)7-6-12-8-9-17-14(10-12)18-15(16)19/h2-5,8-10H,6-7H2,1H3,(H3,16,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (IQM-CSIC) Curated by ChEMBL					Assay Description Displacement of TAMRA-labeled dexamethasone from full-length human mineralocorticoid receptor expressed in baculovirus infected insect cells after 60...				J Med Chem 60: 2629-2650 (2017) Article DOI: 10.1021/acs.jmedchem.6b01065 BindingDB Entry DOI: 10.7270/Q2HD7XXB
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50398058 (CHEMBL2181933 | US8722709, 24) Show SMILES Cc1ccccc1CCc1ccnc(NC(N)=O)c1 Show InChI InChI=1S/C15H17N3O/c1-11-4-2-3-5-13(11)7-6-12-8-9-17-14(10-12)18-15(16)19/h2-5,8-10H,6-7H2,1H3,(H3,16,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.10	n/a	n/a	n/a	n/a	7.4	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The MR competitive binding assay is based on the binding and displacement of a TAMRA-labeled Dexamethasone probe with fluorescence polarization (FP) ...				US Patent US8722709 (2014) BindingDB Entry DOI: 10.7270/Q2NS0SJ4
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50398058 (CHEMBL2181933 | US8722709, 24) Show SMILES Cc1ccccc1CCc1ccnc(NC(N)=O)c1 Show InChI InChI=1S/C15H17N3O/c1-11-4-2-3-5-13(11)7-6-12-8-9-17-14(10-12)18-15(16)19/h2-5,8-10H,6-7H2,1H3,(H3,16,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of TAMRA-labeled Dexamethasone from human mineralocorticoid receptor expressed in baculovirus infected insect cell lysate after 60 mins ...				J Med Chem 55: 7957-66 (2012) Article DOI: 10.1021/jm300806c BindingDB Entry DOI: 10.7270/Q2QC04N3
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013416 (CHEMBL3263754) Show SMILES COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:12| Show InChI InChI=1S/C22H23N5O3/c1-13-15(12-23)7-10-20(24-13)27-19(14-5-3-4-6-14)11-18(26-27)17-9-8-16(22(28)29)21(25-17)30-2/h7-10,14,19H,3-6,11H2,1-2H3,(H,28,29)/t19-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50201104 (4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-N-...) Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(C(=O)Nc1ccc2c(c1)c(C)noc2=O)C(F)(F)F Show InChI InChI=1S/C23H22F4N2O5/c1-12-16-10-14(6-7-15(16)19(30)34-29-12)28-20(31)22(32,23(25,26)27)11-21(2,3)17-9-13(24)5-8-18(17)33-4/h5-10,32H,11H2,1-4H3,(H,28,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.94	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Schering Pharma AG Curated by ChEMBL					Assay Description Binding affinity to human recombinant mineralocorticoid receptor expressed in baculovirus infected Sf9 cells				Bioorg Med Chem Lett 20: 5835-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.125 BindingDB Entry DOI: 10.7270/Q26974V3
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50024849 (CHEMBL3337825) Show SMILES Cc1nn(CCCC(F)(F)F)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C22H19F4N3O2/c1-13-20(15-5-8-18-17(11-15)27-19(30)12-31-18)21(14-3-6-16(23)7-4-14)29(28-13)10-2-9-22(24,25)26/h3-8,11H,2,9-10,12H2,1H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Limited Curated by ChEMBL					Assay Description Displacement of [3H]aldosterone from human mineralocorticoid receptor expressed in 293 cells after 16 hrs by scintillation counting				Bioorg Med Chem 22: 5428-45 (2014) Article DOI: 10.1016/j.bmc.2014.07.038 BindingDB Entry DOI: 10.7270/Q218383G
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50228080 (2',15'-dimethyl-5,5'-dioxo-(9'R)-spiro[tetrahydrof...) Show SMILES CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]33CCC(=O)O3)[C@H]12 |r,t:6| Show InChI InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c00402 BindingDB Entry DOI: 10.7270/Q2571H1M
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324117 (CHEMBL1215552 | Methyl 2-((1H-Imidazol-1-yl)methyl...) Show SMILES COC(=O)C1=C(Cn2ccnc2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:13| Show InChI InChI=1S/C19H16ClFN4O2/c1-11-14(8-22)17(13-4-3-12(21)7-15(13)20)18(19(26)27-2)16(24-11)9-25-6-5-23-10-25/h3-7,10,14,17H,9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor LBD expressed in human HUH7 cells coexpressing GAL4 by luciferase reporter gene assay				J Med Chem 53: 5970-8 (2010) Article DOI: 10.1021/jm100506y BindingDB Entry DOI: 10.7270/Q2XW4KST
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324210 ((+/-)-(3SR,3aRS)-2-(3-Chloro-4-cyanophenyl)-3-cycl...) Show SMILES OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7| Show InChI InChI=1S/C24H22ClN3O2/c25-21-12-18(8-5-17(21)13-26)28-23(14-3-1-2-4-14)20-10-6-15-11-16(24(29)30)7-9-19(15)22(20)27-28/h5,7-9,11-12,14,20,23H,1-4,6,10H2,(H,29,30)/t20-,23-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to mineralocorticoid receptor (unknown origin)				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013413 (CHEMBL3263750) Show SMILES COc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12| Show InChI InChI=1S/C24H25N3O3/c1-15-11-19(9-7-18(15)14-25)27-22(16-5-3-4-6-16)13-21(26-27)17-8-10-20(24(28)29)23(12-17)30-2/h7-12,16,22H,3-6,13H2,1-2H3,(H,28,29)/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324210 ((+/-)-(3SR,3aRS)-2-(3-Chloro-4-cyanophenyl)-3-cycl...) Show SMILES OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7| Show InChI InChI=1S/C24H22ClN3O2/c25-21-12-18(8-5-17(21)13-26)28-23(14-3-1-2-4-14)20-10-6-15-11-16(24(29)30)7-9-19(15)22(20)27-28/h5,7-9,11-12,14,20,23H,1-4,6,10H2,(H,29,30)/t20-,23-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair

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