Compile Data Set for Download or QSAR

Found 53 hits with Last Name = 'hughes' and Initial = 'rb'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Estrogen receptor beta (Homo sapiens (Human))	BDBM20607 ((2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethy...) Show SMILES CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	157	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor				J Med Chem 44: 1072-84 (2001) Article DOI: 10.1021/jm001119l BindingDB Entry DOI: 10.7270/Q2DZ0C2F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50473570 (CHEMBL11389) Show SMILES CC\C(=C(/Cc1ccccc1)c1ccc(OCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(22-13-9-6-10-14-22)26(19-21-11-7-5-8-12-21)23-15-17-24(18-16-23)28-20-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	503	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor.				J Med Chem 44: 1072-84 (2001) Article DOI: 10.1021/jm001119l BindingDB Entry DOI: 10.7270/Q2DZ0C2F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50473572 (CHEMBL11283) Show SMILES CC\C(=C(/Cc1ccccc1)c1ccccc1)c1ccc(OCN2CCCCC2)cc1 Show InChI InChI=1S/C29H33NO/c1-2-28(26-16-18-27(19-17-26)31-23-30-20-10-5-11-21-30)29(25-14-8-4-9-15-25)22-24-12-6-3-7-13-24/h3-4,6-9,12-19H,2,5,10-11,20-23H2,1H3/b29-28-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor.				J Med Chem 44: 1072-84 (2001) Article DOI: 10.1021/jm001119l BindingDB Entry DOI: 10.7270/Q2DZ0C2F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50473569 (CHEMBL11702) Show SMILES CC\C(=C(\Cc1ccc(OCN2CCOCC2)cc1)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31NO2/c1-2-27(24-9-5-3-6-10-24)28(25-11-7-4-8-12-25)21-23-13-15-26(16-14-23)31-22-29-17-19-30-20-18-29/h3-16H,2,17-22H2,1H3/b28-27+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor.				J Med Chem 44: 1072-84 (2001) Article DOI: 10.1021/jm001119l BindingDB Entry DOI: 10.7270/Q2DZ0C2F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475166 (CHEMBL190972) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:13| Show InChI InChI=1S/C26H27NO2/c1-27(2)17-19-28-22-14-12-21(13-15-22)26-23(20-8-4-3-5-9-20)16-18-29-25-11-7-6-10-24(25)26/h3-15H,16-19H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor of human breast carcinoma (MCF-7) cell line				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50473571 (CHEMBL273978) Show SMILES CC\C(Cc1ccccc1)=C(/c1ccccc1)c1ccc(OCN(C)C)cc1 Show InChI InChI=1S/C26H29NO/c1-4-22(19-21-11-7-5-8-12-21)26(23-13-9-6-10-14-23)24-15-17-25(18-16-24)28-20-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-22-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.59E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor.				J Med Chem 44: 1072-84 (2001) Article DOI: 10.1021/jm001119l BindingDB Entry DOI: 10.7270/Q2DZ0C2F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475168 (CHEMBL186274) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccc(C)cc1 |t:13| Show InChI InChI=1S/C27H29NO2/c1-20-8-10-21(11-9-20)24-16-18-30-26-7-5-4-6-25(26)27(24)22-12-14-23(15-13-22)29-19-17-28(2)3/h4-15H,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.28E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor of human breast carcinoma (MCF-7) cell line; 828 +/- 106 uM				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275964 (4-{8-Fluoro-5-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H28FNO3/c29-22-7-12-26-27(19-22)33-17-13-25(20-3-8-23(31)9-4-20)28(26)21-5-10-24(11-6-21)32-18-16-30-14-1-2-15-30/h3-12,19,31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275861 (4-{5-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-2,3-dih...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCC3)cc2)c2ccccc2OCC1 |c:8| Show InChI InChI=1S/C27H27NO3/c29-22-10-6-20(7-11-22)24-14-18-31-26-5-2-1-4-25(26)27(24)21-8-12-23(13-9-21)30-19-17-28-15-3-16-28/h1-2,4-13,29H,3,14-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275918 (4-(4-Hydroxyphenyl)-5-[4-(2-pyrrolidin-1-yl-ethoxy...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(O)cc2OCC1 |c:8| Show InChI InChI=1S/C28H29NO4/c30-22-7-3-20(4-8-22)25-13-17-33-27-19-23(31)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-29-14-1-2-15-29/h3-12,19,30-31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275917 (4-{8-Methoxy-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl...) Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCCC3)cc2)c1 |c:18| Show InChI InChI=1S/C29H31NO4/c1-32-25-12-13-27-28(20-25)34-18-14-26(21-4-8-23(31)9-5-21)29(27)22-6-10-24(11-7-22)33-19-17-30-15-2-3-16-30/h4-13,20,31H,2-3,14-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.63	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275916 (4-{8-Methoxy-5-[4-(2-pyrrolidin-1-yl-ethoxy)-pheny...) Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCC3)cc2)c1 |c:18| Show InChI InChI=1S/C28H29NO4/c1-31-24-11-12-26-27(19-24)33-17-13-25(20-3-7-22(30)8-4-20)28(26)21-5-9-23(10-6-21)32-18-16-29-14-2-15-29/h3-12,19,30H,2,13-18H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.61	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50276005 (CHEMBL472468 | [4-{8-Fluoro-4-[4-(2-pyrrolidin-1-y...) Show SMILES Oc1ccc(cc1)C1=C(CCOc2cc(F)ccc12)c1ccc(OCCN2CCCC2)cc1 |t:8| Show InChI InChI=1S/C28H28FNO3/c29-22-7-12-26-27(19-22)33-17-13-25(28(26)21-3-8-23(31)9-4-21)20-5-10-24(11-6-20)32-18-16-30-14-1-2-15-30/h3-12,19,31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.57	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275861 (4-{5-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-2,3-dih...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCC3)cc2)c2ccccc2OCC1 |c:8| Show InChI InChI=1S/C27H27NO3/c29-22-10-6-20(7-11-22)24-14-18-31-26-5-2-1-4-25(26)27(24)21-8-12-23(13-9-21)30-19-17-28-15-3-16-28/h1-2,4-13,29H,3,14-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275965 (3-{8-Fluoro-5-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl...) Show SMILES Oc1cccc(c1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H28FNO3/c29-22-8-11-26-27(19-22)33-16-12-25(21-4-3-5-23(31)18-21)28(26)20-6-9-24(10-7-20)32-17-15-30-13-1-2-14-30/h3-11,18-19,31H,1-2,12-17H2	PDB UniProtKB/SwissProt 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
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50276004 (4-{8-Fluoro-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl]...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C29H30FNO3/c30-23-8-13-27-28(20-23)34-18-14-26(21-4-9-24(32)10-5-21)29(27)22-6-11-25(12-7-22)33-19-17-31-15-2-1-3-16-31/h4-13,20,32H,1-3,14-19H2	PDB UniProtKB/SwissProt 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
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275916 (4-{8-Methoxy-5-[4-(2-pyrrolidin-1-yl-ethoxy)-pheny...) Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCC3)cc2)c1 |c:18| Show InChI InChI=1S/C28H29NO4/c1-31-24-11-12-26-27(19-24)33-17-13-25(20-3-7-22(30)8-4-20)28(26)21-5-9-23(10-6-21)32-18-16-29-14-2-15-29/h3-12,19,30H,2,13-18H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.70	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275918 (4-(4-Hydroxyphenyl)-5-[4-(2-pyrrolidin-1-yl-ethoxy...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(O)cc2OCC1 |c:8| Show InChI InChI=1S/C28H29NO4/c30-22-7-3-20(4-8-22)25-13-17-33-27-19-23(31)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-29-14-1-2-15-29/h3-12,19,30-31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275860 (1-{2-[4-(4-Phenyl-2,3-dihydro-benzo[b]oxepin-5-yl)...) Show SMILES C(CN1CCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:15| Show InChI InChI=1S/C27H27NO2/c1-2-7-21(8-3-1)24-15-19-30-26-10-5-4-9-25(26)27(24)22-11-13-23(14-12-22)29-20-18-28-16-6-17-28/h1-5,7-14H,6,15-20H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.77	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50276004 (4-{8-Fluoro-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl]...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C29H30FNO3/c30-23-8-13-27-28(20-23)34-18-14-26(21-4-9-24(32)10-5-21)29(27)22-6-11-25(12-7-22)33-19-17-31-15-2-1-3-16-31/h4-13,20,32H,1-3,14-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.78	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275917 (4-{8-Methoxy-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl...) Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCCC3)cc2)c1 |c:18| Show InChI InChI=1S/C29H31NO4/c1-32-25-12-13-27-28(20-25)34-18-14-26(21-4-8-23(31)9-5-21)29(27)22-6-10-24(11-7-22)33-19-17-30-15-2-3-16-30/h4-13,20,31H,2-3,14-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10.3	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275964 (4-{8-Fluoro-5-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl...) Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H28FNO3/c29-22-7-12-26-27(19-22)33-17-13-25(20-3-8-23(31)9-4-20)28(26)21-5-10-24(11-6-21)32-18-16-30-14-1-2-15-30/h3-12,19,31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10.4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275965 (3-{8-Fluoro-5-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl...) Show SMILES Oc1cccc(c1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H28FNO3/c29-22-8-11-26-27(19-22)33-16-12-25(21-4-3-5-23(31)18-21)28(26)20-6-9-24(10-7-20)32-17-15-30-13-1-2-14-30/h3-11,18-19,31H,1-2,12-17H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275919 (1-{2-[4-(8-Fluoro-4-phenyl-2,3-dihydro-benzo[b]oxe...) Show SMILES Fc1ccc2c(OCCC(c3ccccc3)=C2c2ccc(OCCN3CCCC3)cc2)c1 |c:16| Show InChI InChI=1S/C28H28FNO2/c29-23-10-13-26-27(20-23)32-18-14-25(21-6-2-1-3-7-21)28(26)22-8-11-24(12-9-22)31-19-17-30-15-4-5-16-30/h1-3,6-13,20H,4-5,14-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16.2	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50276005 (CHEMBL472468 | [4-{8-Fluoro-4-[4-(2-pyrrolidin-1-y...) Show SMILES Oc1ccc(cc1)C1=C(CCOc2cc(F)ccc12)c1ccc(OCCN2CCCC2)cc1 |t:8| Show InChI InChI=1S/C28H28FNO3/c29-22-7-12-26-27(19-22)33-17-13-25(28(26)21-3-8-23(31)9-4-21)20-5-10-24(11-6-20)32-18-16-30-14-1-2-15-30/h3-12,19,31H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17.3	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM20608 (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-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275919 (1-{2-[4-(8-Fluoro-4-phenyl-2,3-dihydro-benzo[b]oxe...) Show SMILES Fc1ccc2c(OCCC(c3ccccc3)=C2c2ccc(OCCN3CCCC3)cc2)c1 |c:16| Show InChI InChI=1S/C28H28FNO2/c29-23-10-13-26-27(20-23)32-18-14-25(21-6-2-1-3-7-21)28(26)22-8-11-24(12-9-22)31-19-17-30-15-4-5-16-30/h1-3,6-13,20H,4-5,14-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM20608 (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-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275860 (1-{2-[4-(4-Phenyl-2,3-dihydro-benzo[b]oxepin-5-yl)...) Show SMILES C(CN1CCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:15| Show InChI InChI=1S/C27H27NO2/c1-2-7-21(8-3-1)24-15-19-30-26-10-5-4-9-25(26)27(24)22-11-13-23(14-12-22)29-20-18-28-16-6-17-28/h1-5,7-14H,6,15-20H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46.1	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM20607 ((2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethy...) Show SMILES CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275966 (1-(2-{4-[8-Fluoro-4-(4-fluorophenyl)-2,3-dihydro-b...) Show SMILES Fc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H27F2NO2/c29-22-7-3-20(4-8-22)25-13-17-33-27-19-23(30)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-31-14-1-2-15-31/h3-12,19H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM20607 ((2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethy...) Show SMILES CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275966 (1-(2-{4-[8-Fluoro-4-(4-fluorophenyl)-2,3-dihydro-b...) Show SMILES Fc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H27F2NO2/c29-22-7-3-20(4-8-22)25-13-17-33-27-19-23(30)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-31-14-1-2-15-31/h3-12,19H,1-2,13-18H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	262	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (RAT)	BDBM50276006 (CHEMBL472469 | Dimethyl-{2-[4-(4-thiophen-2-yl-2,3...) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1cccs1 |t:13| Show InChI InChI=1S/C24H25NO2S/c1-25(2)14-16-26-19-11-9-18(10-12-19)24-20-6-3-4-7-22(20)27-15-13-21(24)23-8-5-17-28-23/h3-12,17H,13-16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	828	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from ERalpha in rat uteri cytosol by competitive radiometric binding assay				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Rattus norvegicus)	BDBM50276006 (CHEMBL472469 | Dimethyl-{2-[4-(4-thiophen-2-yl-2,3...) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1cccs1 |t:13| Show InChI InChI=1S/C24H25NO2S/c1-25(2)14-16-26-19-11-9-18(10-12-19)24-20-6-3-4-7-22(20)27-15-13-21(24)23-8-5-17-28-23/h3-12,17H,13-16H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	828	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from ERbeta receptor in rat uteri cytosol by competitive radiometric binding assay				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475163 (CHEMBL189022) Show SMILES C(CN1CCCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:16| Show InChI InChI=1S/C28H29NO2/c1-2-8-22(9-3-1)25-16-20-31-27-11-5-4-10-26(27)28(25)23-12-14-24(15-13-23)30-21-19-29-17-6-7-18-29/h1-5,8-15H,6-7,16-21H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475173 (CHEMBL366274) Show SMILES C(CN1CCOCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:17| Show InChI InChI=1S/C28H29NO3/c1-2-6-22(7-3-1)25-14-18-32-27-9-5-4-8-26(27)28(25)23-10-12-24(13-11-23)31-21-17-29-15-19-30-20-16-29/h1-13H,14-21H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475167 (CHEMBL188519) Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:17| Show InChI InChI=1S/C29H31NO2/c1-3-9-23(10-4-1)26-17-21-32-28-12-6-5-11-27(28)29(26)24-13-15-25(16-14-24)31-22-20-30-18-7-2-8-19-30/h1,3-6,9-16H,2,7-8,17-22H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475174 (CHEMBL187400) Show SMILES COc1ccc(cc1)C1=C(c2ccc(OCCN(C)C)cc2)c2ccccc2OCC1 |c:9| Show InChI InChI=1S/C27H29NO3/c1-28(2)17-19-30-23-14-10-21(11-15-23)27-24(20-8-12-22(29-3)13-9-20)16-18-31-26-7-5-4-6-25(26)27/h4-15H,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM20607 ((2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethy...) Show SMILES CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475171 (CHEMBL186237) Show SMILES COc1ccccc1C1=C(c2ccc(OCCN(C)C)cc2)c2ccccc2OCC1 |c:9| Show InChI InChI=1S/C27H29NO3/c1-28(2)17-19-30-21-14-12-20(13-15-21)27-23(22-8-4-6-10-25(22)29-3)16-18-31-26-11-7-5-9-24(26)27/h4-15H,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475170 (CHEMBL426804) Show SMILES CCN(CC)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:15| Show InChI InChI=1S/C28H31NO2/c1-3-29(4-2)19-21-30-24-16-14-23(15-17-24)28-25(22-10-6-5-7-11-22)18-20-31-27-13-9-8-12-26(27)28/h5-17H,3-4,18-21H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor (RAT)	BDBM50276007 (1-(2-{4-[4-(4-Methylbenzyl)-2,3-dihydro-benzo[b]ox...) Show SMILES Cc1ccc(CC2=C(c3ccc(OCCN4CCCC4)cc3)c3ccccc3OCC2)cc1 |c:6| Show InChI InChI=1S/C30H33NO2/c1-23-8-10-24(11-9-23)22-26-16-20-33-29-7-3-2-6-28(29)30(26)25-12-14-27(15-13-25)32-21-19-31-17-4-5-18-31/h2-3,6-15H,4-5,16-22H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from ERalpha in rat uteri cytosol by competitive radiometric binding assay				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Rattus norvegicus)	BDBM50276007 (1-(2-{4-[4-(4-Methylbenzyl)-2,3-dihydro-benzo[b]ox...) Show SMILES Cc1ccc(CC2=C(c3ccc(OCCN4CCCC4)cc3)c3ccccc3OCC2)cc1 |c:6| Show InChI InChI=1S/C30H33NO2/c1-23-8-10-24(11-9-23)22-26-16-20-33-29-7-3-2-6-28(29)30(26)25-12-14-27(15-13-25)32-21-19-31-17-4-5-18-31/h2-3,6-15H,4-5,16-22H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from ERbeta receptor in rat uteri cytosol by competitive radiometric binding assay				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275967 (1-(2-{4-[8-Fluoro-4-(4-methanesulfonyl-phenyl)-2,3...) Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:11| Show InChI InChI=1S/C29H30FNO4S/c1-36(32,33)25-11-6-21(7-12-25)26-14-18-35-28-20-23(30)8-13-27(28)29(26)22-4-9-24(10-5-22)34-19-17-31-15-2-3-16-31/h4-13,20H,2-3,14-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50275967 (1-(2-{4-[8-Fluoro-4-(4-methanesulfonyl-phenyl)-2,3...) Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:11| Show InChI InChI=1S/C29H30FNO4S/c1-36(32,33)25-11-6-21(7-12-25)26-14-18-35-28-20-23(30)8-13-27(28)29(26)22-4-9-24(10-5-22)34-19-17-31-15-2-3-16-31/h4-13,20H,2-3,14-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475168 (CHEMBL186274) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccc(C)cc1 |t:13| Show InChI InChI=1S/C27H29NO2/c1-20-8-10-21(11-9-20)24-16-18-30-26-7-5-4-6-25(26)27(24)22-12-14-23(15-13-22)29-19-17-28(2)3/h4-15H,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475166 (CHEMBL190972) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1 |t:13| Show InChI InChI=1S/C26H27NO2/c1-27(2)17-19-28-22-14-12-21(13-15-22)26-23(20-8-4-3-5-9-20)16-18-29-25-11-7-6-10-24(25)26/h3-15H,16-19H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475165 (CHEMBL186797) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccc(Cl)cc1 |t:13| Show InChI InChI=1S/C26H26ClNO2/c1-28(2)16-18-29-22-13-9-20(10-14-22)26-23(19-7-11-21(27)12-8-19)15-17-30-25-6-4-3-5-24(25)26/h3-14H,15-18H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475169 (CHEMBL186728) Show SMILES CN(C)CCOc1ccc(cc1)C1=C(CCOc2ccccc12)c1cccc(C)c1 |t:13| Show InChI InChI=1S/C27H29NO2/c1-20-7-6-8-22(19-20)24-15-17-30-26-10-5-4-9-25(26)27(24)21-11-13-23(14-12-21)29-18-16-28(2)3/h4-14,19H,15-18H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Dublin Curated by ChEMBL					Assay Description Inhibition of estrogen receptor positive human breast carcinoma (MCF-7) cell proliferation				J Med Chem 47: 5612-5 (2004) Article DOI: 10.1021/jm0495834 BindingDB Entry DOI: 10.7270/Q2M0486Q
					More data for this Ligand-Target Pair

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