Compile Data Set for Download or QSAR

Found 34 hits with Last Name = 'kadwell' and Initial = 'sh'   

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 (Homo sapiens (Human))	BDBM17292 ((1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{...) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor (Homo sapiens (Human))	BDBM50084948 (CHEMBL195515 | GW7604) Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(\C=C\C(O)=O)cc1)c1ccccc1 Show InChI InChI=1S/C25H22O3/c1-2-23(19-6-4-3-5-7-19)25(21-13-15-22(26)16-14-21)20-11-8-18(9-12-20)10-17-24(27)28/h3-17,26H,2H2,1H3,(H,27,28)/b17-10+,25-23+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50276802 (4-OHT | Afimoxifene | TamoGel) Show SMILES CCC(=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 PC cid PC sid UniChem Patents	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM17292 ((1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{...) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (Homo sapiens (Human))	BDBM50276802 (4-OHT | Afimoxifene | TamoGel) Show SMILES CCC(=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 PC cid PC sid UniChem Patents	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475356 (CHEMBL195080) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(OCCN(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C27H28N2O3/c1-4-24-26(19-8-6-5-7-9-19)27(23-15-10-20(30)18-25(23)28-24)32-22-13-11-21(12-14-22)31-17-16-29(2)3/h5-15,18,30H,4,16-17H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475363 (CHEMBL194774) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C28H26N2O3/c1-4-24-27(20-8-6-5-7-9-20)28(23-16-13-21(31)18-25(23)29-24)33-22-14-10-19(11-15-22)12-17-26(32)30(2)3/h5-18,31H,4H2,1-3H3/b17-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475364 (CHEMBL370750) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)NC(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C29H28N2O3/c1-4-25-28(21-8-6-5-7-9-21)29(24-16-13-22(32)18-26(24)31-25)34-23-14-10-20(11-15-23)12-17-27(33)30-19(2)3/h5-19,32H,4H2,1-3H3,(H,30,33)/b17-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475356 (CHEMBL195080) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(OCCN(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C27H28N2O3/c1-4-24-26(19-8-6-5-7-9-19)27(23-15-10-20(30)18-25(23)28-24)32-22-13-11-21(12-14-22)31-17-16-29(2)3/h5-15,18,30H,4,16-17H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50084948 (CHEMBL195515 | GW7604) Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(\C=C\C(O)=O)cc1)c1ccccc1 Show InChI InChI=1S/C25H22O3/c1-2-23(19-6-4-3-5-7-19)25(21-13-15-22(26)16-14-21)20-11-8-18(9-12-20)10-17-24(27)28/h3-17,26H,2H2,1H3,(H,27,28)/b17-10+,25-23+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475361 (CHEMBL363630) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(N)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H22N2O3/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(29)16-23(21)28-22)31-20-12-8-17(9-13-20)10-15-24(27)30/h3-16,29H,2H2,1H3,(H2,27,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475364 (CHEMBL370750) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)NC(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C29H28N2O3/c1-4-25-28(21-8-6-5-7-9-21)29(24-16-13-22(32)18-26(24)31-25)34-23-14-10-20(11-15-23)12-17-27(33)30-19(2)3/h5-19,32H,4H2,1-3H3,(H,30,33)/b17-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475363 (CHEMBL194774) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C28H26N2O3/c1-4-24-27(20-8-6-5-7-9-20)28(23-16-13-21(31)18-25(23)29-24)33-22-14-10-19(11-15-22)12-17-26(32)30(2)3/h5-18,31H,4H2,1-3H3/b17-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475360 (CHEMBL193865) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N3CCCCC3)cc2)c1-c1ccccc1 Show InChI InChI=1S/C31H30N2O3/c1-2-27-30(23-9-5-3-6-10-23)31(26-17-14-24(34)21-28(26)32-27)36-25-15-11-22(12-16-25)13-18-29(35)33-19-7-4-8-20-33/h3,5-6,9-18,21,34H,2,4,7-8,19-20H2,1H3/b18-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475361 (CHEMBL363630) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(N)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H22N2O3/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(29)16-23(21)28-22)31-20-12-8-17(9-13-20)10-15-24(27)30/h3-16,29H,2H2,1H3,(H2,27,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475360 (CHEMBL193865) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N3CCCCC3)cc2)c1-c1ccccc1 Show InChI InChI=1S/C31H30N2O3/c1-2-27-30(23-9-5-3-6-10-23)31(26-17-14-24(34)21-28(26)32-27)36-25-15-11-22(12-16-25)13-18-29(35)33-19-7-4-8-20-33/h3,5-6,9-18,21,34H,2,4,7-8,19-20H2,1H3/b18-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475357 (CHEMBL370492) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H21NO4/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(28)16-23(21)27-22)31-20-12-8-17(9-13-20)10-15-24(29)30/h3-16,28H,2H2,1H3,(H,29,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475358 (CHEMBL192025) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C27H20F3NO4/c1-2-22-25(17-4-3-5-18(14-17)27(28,29)30)26(21-12-9-19(32)15-23(21)31-22)35-20-10-6-16(7-11-20)8-13-24(33)34/h3-15,32H,2H2,1H3,(H,33,34)/b13-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475357 (CHEMBL370492) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H21NO4/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(28)16-23(21)27-22)31-20-12-8-17(9-13-20)10-15-24(29)30/h3-16,28H,2H2,1H3,(H,29,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475358 (CHEMBL192025) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C27H20F3NO4/c1-2-22-25(17-4-3-5-18(14-17)27(28,29)30)26(21-12-9-19(32)15-23(21)31-22)35-20-10-6-16(7-11-20)8-13-24(33)34/h3-15,32H,2H2,1H3,(H,33,34)/b13-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	251	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475359 (CHEMBL194600) Show SMILES OC(=O)\C=C\c1ccc(Oc2c(-c3ccccc3)c(nc3cc(O)ccc23)-c2ccccc2)cc1 Show InChI InChI=1S/C30H21NO4/c32-23-14-17-25-26(19-23)31-29(22-9-5-2-6-10-22)28(21-7-3-1-4-8-21)30(25)35-24-15-11-20(12-16-24)13-18-27(33)34/h1-19,32H,(H,33,34)/b18-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475362 (CHEMBL193730) Show SMILES CCc1nc2cc(O)ccc2c(Oc2cccc(\C=C\C(O)=O)c2)c1-c1ccccc1 Show InChI InChI=1S/C26H21NO4/c1-2-22-25(18-8-4-3-5-9-18)26(21-13-12-19(28)16-23(21)27-22)31-20-10-6-7-17(15-20)11-14-24(29)30/h3-16,28H,2H2,1H3,(H,29,30)/b14-11+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor beta				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475362 (CHEMBL193730) Show SMILES CCc1nc2cc(O)ccc2c(Oc2cccc(\C=C\C(O)=O)c2)c1-c1ccccc1 Show InChI InChI=1S/C26H21NO4/c1-2-22-25(18-8-4-3-5-9-18)26(21-13-12-19(28)16-23(21)27-22)31-20-10-6-7-17(15-20)11-14-24(29)30/h3-16,28H,2H2,1H3,(H,29,30)/b14-11+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50475359 (CHEMBL194600) Show SMILES OC(=O)\C=C\c1ccc(Oc2c(-c3ccccc3)c(nc3cc(O)ccc23)-c2ccccc2)cc1 Show InChI InChI=1S/C30H21NO4/c32-23-14-17-25-26(19-23)31-29(22-9-5-2-6-10-22)28(21-7-3-1-4-8-21)30(25)35-24-15-11-20(12-16-24)13-18-27(33)34/h1-19,32H,(H,33,34)/b18-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description Binding affinity for human estrogen receptor alpha				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50084948 (CHEMBL195515 | GW7604) Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(\C=C\C(O)=O)cc1)c1ccccc1 Show InChI InChI=1S/C25H22O3/c1-2-23(19-6-4-3-5-7-19)25(21-13-15-22(26)16-14-21)20-11-8-18(9-12-20)10-17-24(27)28/h3-17,26H,2H2,1H3,(H,27,28)/b17-10+,25-23+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50276802 (4-OHT | Afimoxifene | TamoGel) Show SMILES CCC(=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 antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475356 (CHEMBL195080) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(OCCN(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C27H28N2O3/c1-4-24-26(19-8-6-5-7-9-19)27(23-15-10-20(30)18-25(23)28-24)32-22-13-11-21(12-14-22)31-17-16-29(2)3/h5-15,18,30H,4,16-17H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475363 (CHEMBL194774) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C28H26N2O3/c1-4-24-27(20-8-6-5-7-9-20)28(23-16-13-21(31)18-25(23)29-24)33-22-14-10-19(11-15-22)12-17-26(32)30(2)3/h5-18,31H,4H2,1-3H3/b17-12+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475360 (CHEMBL193865) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)N3CCCCC3)cc2)c1-c1ccccc1 Show InChI InChI=1S/C31H30N2O3/c1-2-27-30(23-9-5-3-6-10-23)31(26-17-14-24(34)21-28(26)32-27)36-25-15-11-22(12-16-25)13-18-29(35)33-19-7-4-8-20-33/h3,5-6,9-18,21,34H,2,4,7-8,19-20H2,1H3/b18-13+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475358 (CHEMBL192025) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C27H20F3NO4/c1-2-22-25(17-4-3-5-18(14-17)27(28,29)30)26(21-12-9-19(32)15-23(21)31-22)35-20-10-6-16(7-11-20)8-13-24(33)34/h3-15,32H,2H2,1H3,(H,33,34)/b13-8+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475364 (CHEMBL370750) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(=O)NC(C)C)cc2)c1-c1ccccc1 Show InChI InChI=1S/C29H28N2O3/c1-4-25-28(21-8-6-5-7-9-21)29(24-16-13-22(32)18-26(24)31-25)34-23-14-10-20(11-15-23)12-17-27(33)30-19(2)3/h5-19,32H,4H2,1-3H3,(H,30,33)/b17-12+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475361 (CHEMBL363630) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(N)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H22N2O3/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(29)16-23(21)28-22)31-20-12-8-17(9-13-20)10-15-24(27)30/h3-16,29H,2H2,1H3,(H2,27,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475357 (CHEMBL370492) Show SMILES CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(O)=O)cc2)c1-c1ccccc1 Show InChI InChI=1S/C26H21NO4/c1-2-22-25(18-6-4-3-5-7-18)26(21-14-11-19(28)16-23(21)27-22)31-20-12-8-17(9-13-20)10-15-24(29)30/h3-16,28H,2H2,1H3,(H,29,30)/b15-10+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50475359 (CHEMBL194600) Show SMILES OC(=O)\C=C\c1ccc(Oc2c(-c3ccccc3)c(nc3cc(O)ccc23)-c2ccccc2)cc1 Show InChI InChI=1S/C30H21NO4/c32-23-14-17-25-26(19-23)31-29(22-9-5-2-6-10-22)28(21-7-3-1-4-8-21)30(25)35-24-15-11-20(12-16-24)13-18-27(33)34/h1-19,32H,(H,33,34)/b18-13+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research & Development Curated by ChEMBL					Assay Description pIC50 for 1 nM estradiol-induced Ishikawa cell proliferation				J Med Chem 48: 2243-7 (2005) Article DOI: 10.1021/jm040154f BindingDB Entry DOI: 10.7270/Q24T6N42
					More data for this Ligand-Target Pair