Compile Data Set for Download or QSAR

Found 21 hits of ec50 for UniProtKB: P06211   

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
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227469 (CHEMBL285536) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccc(F)cc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15FO2/c21-17-7-1-14(2-8-17)13-20(15-3-9-18(22)10-4-15)16-5-11-19(23)12-6-16/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.90	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50023749 (4-(1,2-diphenyl-vinyl)-phenol | 4-[1-(4-hydroxyphe...) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccccc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H16O2/c21-18-10-6-16(7-11-18)20(14-15-4-2-1-3-5-15)17-8-12-19(22)13-9-17/h1-14,21-22H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	n/a	n/a	3.20	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227471 (CHEMBL287352) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccc(I)cc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15IO2/c21-17-7-1-14(2-8-17)13-20(15-3-9-18(22)10-4-15)16-5-11-19(23)12-6-16/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.30	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227470 (CHEMBL34648) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6](/Cl)-c1ccccc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15ClO2/c21-20(16-4-2-1-3-5-16)19(14-6-10-17(22)11-7-14)15-8-12-18(23)13-9-15/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	4.5	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	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 GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	5.70	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (RAT-Rattus norvegicus)	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 GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	6	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of 3 nM [3H]4-hydroxytamoxifen from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227471 (CHEMBL287352) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccc(I)cc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15IO2/c21-17-7-1-14(2-8-17)13-20(15-3-9-18(22)10-4-15)16-5-11-19(23)12-6-16/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9.5	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of 3 nM [3H]4-hydroxytamoxifen from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227468 (CHEMBL33879) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccc(Br)cc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15BrO2/c21-17-7-1-14(2-8-17)13-20(15-3-9-18(22)10-4-15)16-5-11-19(23)12-6-16/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50227469 (CHEMBL285536) Show SMILES [#8]-c1ccc(cc1)-[#6](=[#6]\c1ccc(F)cc1)\c1ccc(-[#8])cc1 Show InChI InChI=1S/C20H15FO2/c21-17-7-1-14(2-8-17)13-20(15-3-9-18(22)10-4-15)16-5-11-19(23)12-6-16/h1-13,22-23H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description In vitro displacement of 3 nM [3H]4-hydroxytamoxifen from estrogen receptor of rat uterine cystol				J Med Chem 31: 1471-5 (1988) BindingDB Entry DOI: 10.7270/Q2DN478W
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	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 GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	917	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50187243 (17-ethinyl-3,17-estradiol | 17-ethinyl-3,17-oestra...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)C#C |r| Show InChI InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.68E+3	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	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 GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	1.83E+3	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228276 (CHEMBL1627365) Show SMILES [H][C@@]12CCC(=C)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] |r| Show InChI InChI=1S/C19H24O/c1-12-3-8-18-17-6-4-13-11-14(20)5-7-15(13)16(17)9-10-19(12,18)2/h5,7,11,16-18,20H,1,3-4,6,8-10H2,2H3/t16-,17-,18+,19-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.98E+3	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228275 (CHEMBL1627370) Show SMILES [H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)C[C@H](O)[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C20H24O3/c1-3-20(23)9-8-16-15-6-4-12-10-13(21)5-7-14(12)18(15)17(22)11-19(16,20)2/h1,5,7,10,15-18,21-23H,4,6,8-9,11H2,2H3/t15-,16-,17-,18+,19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.66E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228274 (CHEMBL1627389) Show SMILES [H][C@]1(CC)CC[C@@]2([H])[C@]3([H])CCc4cc(O)ccc4[C@@]3([H])[C@@H](O)C[C@]12C Show InChI InChI=1S/C20H28O2/c1-3-13-5-9-17-16-7-4-12-10-14(21)6-8-15(12)19(16)18(22)11-20(13,17)2/h6,8,10,13,16-19,21-22H,3-5,7,9,11H2,1-2H3/t13-,16-,17-,18-,19+,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228273 (CHEMBL1627375) Show SMILES [H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3C[C@@H](O)[C@@]21[H] Show InChI InChI=1S/C20H24O3/c1-3-20(23)9-7-16-18-15(6-8-19(16,20)2)14-5-4-13(21)10-12(14)11-17(18)22/h1,4-5,10,15-18,21-23H,6-9,11H2,2H3/t15-,16+,17-,18-,19+,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228277 (CHEMBL1627386) Show SMILES [H][C@]1(CC)CC[C@@]2([H])[C@]3([H])CCc4cc(O)ccc4[C@@]3([H])CC[C@]12C Show InChI InChI=1S/C20H28O/c1-3-14-5-9-19-18-7-4-13-12-15(21)6-8-16(13)17(18)10-11-20(14,19)2/h6,8,12,14,17-19,21H,3-5,7,9-11H2,1-2H3/t14-,17+,18+,19-,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	2.81E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50187243 (17-ethinyl-3,17-estradiol | 17-ethinyl-3,17-oestra...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)C#C |r| Show InChI InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	>3.37E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228275 (CHEMBL1627370) Show SMILES [H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)C[C@H](O)[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C20H24O3/c1-3-20(23)9-8-16-15-6-4-12-10-13(21)5-7-14(12)18(15)17(22)11-19(16,20)2/h1,5,7,10,15-18,21-23H,4,6,8-9,11H2,2H3/t15-,16-,17-,18+,19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.12E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in mature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228273 (CHEMBL1627375) Show SMILES [H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3C[C@@H](O)[C@@]21[H] Show InChI InChI=1S/C20H24O3/c1-3-20(23)9-7-16-18-15(6-8-19(16,20)2)14-5-4-13(21)10-12(14)11-17(18)22/h1,4-5,10,15-18,21-23H,6-9,11H2,2H3/t15-,16+,17-,18-,19+,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.76E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair
Estrogen receptor beta (RAT-Rattus norvegicus)	BDBM50228277 (CHEMBL1627386) Show SMILES [H][C@]1(CC)CC[C@@]2([H])[C@]3([H])CCc4cc(O)ccc4[C@@]3([H])CC[C@]12C Show InChI InChI=1S/C20H28O/c1-3-14-5-9-19-18-7-4-13-12-15(21)6-8-16(13)17(18)10-11-20(14,19)2/h6,8,12,14,17-19,21H,3-5,7,9-11H2,1-2H3/t14-,17+,18+,19-,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	7.03E+4	n/a	n/a	n/a	n/a
SRI International Curated by ChEMBL					Assay Description Displacement of [3H]-estradiol from estrogen receptor in immature rat				J Med Chem 32: 1642-52 (1989) BindingDB Entry DOI: 10.7270/Q25141F8
					More data for this Ligand-Target Pair