Compile Data Set for Download or QSAR

Found 140 hits Enz. Inhib. hit(s) with all data for entry = 50046095   

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))	BDBM50094707 (CHEMBL3589346) Show SMILES [H][C@]12C[C@@H]([C@]([H])(O1)C(=C2c1ccc(O)cc1)c1ccc(O)cc1)S(=O)(=O)Oc1ccccc1 |r,c:8,TLB:23:3:7.8:6,THB:9:8:2.3:6,16:7:2.3:6| Show InChI InChI=1S/C55H84N16O16S4.C40H48N2O6/c1-4-27(2)43(58)54(86)69-38-26-91-89-24-36-46(78)60-21-42(75)70-17-7-10-39(70)53(85)62-31(9-5-6-16-56)47(79)63-32(19-29-12-14-30(73)15-13-29)48(80)65-34(22-72)49(81)66-35(44(59)76)23-88-90-25-37(68-51(38)83)50(82)64-33(20-41(57)74)55(87)71-18-8-11-40(71)52(84)61-28(3)45(77)67-36;1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h12-15,27-28,31-40,43,72-73H,4-11,16-26,56,58H2,1-3H3,(H2,57,74)(H2,59,76)(H,60,78)(H,61,84)(H,62,85)(H,63,79)(H,64,82)(H,65,80)(H,66,81)(H,67,77)(H,68,83)(H,69,86);9-14,21-24,31-32H,15-20H2,1-8H3/q;+2/t27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,43-;31-,32+/m00/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094709 (CHEMBL3589349) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:26| Show InChI InChI=1S/C60H93N17O17S2.C40H48N2O6/c1-4-31(2)48(63)59(93)75-42-30-96-95-29-41-51(85)66-27-47(82)76-23-9-13-43(76)58(92)70-36(12-5-7-21-61)52(86)71-38(25-33-15-17-34(79)18-16-33)54(88)73-40(28-78)55(89)68-35(49(64)83)11-6-8-22-65-46(81)20-19-37(69-56(42)90)53(87)72-39(26-45(62)80)60(94)77-24-10-14-44(77)57(91)67-32(3)50(84)74-41;1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h15-18,31-32,35-44,48,78-79H,4-14,19-30,61,63H2,1-3H3,(H2,62,80)(H2,64,83)(H,65,81)(H,66,85)(H,67,91)(H,68,89)(H,69,90)(H,70,92)(H,71,86)(H,72,87)(H,73,88)(H,74,84)(H,75,93);9-14,21-24,31-32H,15-20H2,1-8H3/q;+2/t31-,32-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,48-;31-,32+/m00/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094742 (CHEMBL3589358) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(O)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-13-9-20(10-14-23)30-26-19-27(43(39,40)42-25-17-15-24(35)16-18-25)32(41-26)31(30)21-7-11-22(12-8-21)33-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,34-35H,1-6,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094707 (CHEMBL3589346) Show SMILES [H][C@]12C[C@@H]([C@]([H])(O1)C(=C2c1ccc(O)cc1)c1ccc(O)cc1)S(=O)(=O)Oc1ccccc1 |r,c:8,TLB:23:3:7.8:6,THB:9:8:2.3:6,16:7:2.3:6| Show InChI InChI=1S/C55H84N16O16S4.C40H48N2O6/c1-4-27(2)43(58)54(86)69-38-26-91-89-24-36-46(78)60-21-42(75)70-17-7-10-39(70)53(85)62-31(9-5-6-16-56)47(79)63-32(19-29-12-14-30(73)15-13-29)48(80)65-34(22-72)49(81)66-35(44(59)76)23-88-90-25-37(68-51(38)83)50(82)64-33(20-41(57)74)55(87)71-18-8-11-40(71)52(84)61-28(3)45(77)67-36;1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h12-15,27-28,31-40,43,72-73H,4-11,16-26,56,58H2,1-3H3,(H2,57,74)(H2,59,76)(H,60,78)(H,61,84)(H,62,85)(H,63,79)(H,64,82)(H,65,80)(H,66,81)(H,67,77)(H,68,83)(H,69,86);9-14,21-24,31-32H,15-20H2,1-8H3/q;+2/t27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,43-;31-,32+/m00/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094744 (CHEMBL3589360) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(F)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32FNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094739 (CHEMBL3589368) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc2ccccc2c1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C36H35NO8S/c38-28-18-13-24(14-19-28)34-30-22-31(46(42,43)45-29-20-15-23-7-5-6-8-26(23)21-29)36(44-30)35(34)25-11-16-27(17-12-25)37-32(39)9-3-1-2-4-10-33(40)41/h5-8,11-21,30-31,36,38H,1-4,9-10,22H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	56	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094747 (CHEMBL3589350) Show SMILES OC(=O)CCCCCCC(=O)Nc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)c1 |c:27| Show InChI InChI=1S/C32H33NO9S/c34-23-14-10-20(11-15-23)30-26-19-27(32(41-26)31(30)21-12-16-24(35)17-13-21)43(39,40)42-25-7-5-6-22(18-25)33-28(36)8-3-1-2-4-9-29(37)38/h5-7,10-18,26-27,32,34-35H,1-4,8-9,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	57	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094708 (CHEMBL3589347) Show SMILES COC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:27| Show InChI InChI=1S/C40H48N2O6/c1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h9-14,21-24,31-32H,15-20H2,1-8H3/q+2/t31-,32+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094735 (CHEMBL3589363) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(Br)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32BrNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	61	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094748 (CHEMBL3589353) Show SMILES Cc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)c1 |c:16| Show InChI InChI=1S/C33H35NO8S/c1-21-7-6-8-26(19-21)42-43(39,40)28-20-27-31(22-13-17-25(35)18-14-22)32(33(28)41-27)23-11-15-24(16-12-23)34-29(36)9-4-2-3-5-10-30(37)38/h6-8,11-19,27-28,33,35H,2-5,9-10,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094746 (CHEMBL3589348) Show SMILES COC(=O)CCCCCCC(=O)Nc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)c1 |c:28| Show InChI InChI=1S/C33H35NO9S/c1-41-30(38)10-5-3-2-4-9-29(37)34-23-7-6-8-26(19-23)43-44(39,40)28-20-27-31(21-11-15-24(35)16-12-21)32(33(28)42-27)22-13-17-25(36)18-14-22/h6-8,11-19,27-28,33,35-36H,2-5,9-10,20H2,1H3,(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094748 (CHEMBL3589353) Show SMILES Cc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)c1 |c:16| Show InChI InChI=1S/C33H35NO8S/c1-21-7-6-8-26(19-21)42-43(39,40)28-20-27-31(22-13-17-25(35)18-14-22)32(33(28)41-27)23-11-15-24(16-12-23)34-29(36)9-4-2-3-5-10-30(37)38/h6-8,11-19,27-28,33,35H,2-5,9-10,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	81	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094750 (CHEMBL3589357) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1cccc(O)c1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-16-12-20(13-17-23)30-26-19-27(43(39,40)42-25-7-5-6-24(35)18-25)32(41-26)31(30)21-10-14-22(15-11-21)33-28(36)8-3-1-2-4-9-29(37)38/h5-7,10-18,26-27,32,34-35H,1-4,8-9,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	81	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094749 (CHEMBL3589355) Show SMILES COc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)c1 |c:17| Show InChI InChI=1S/C33H35NO9S/c1-41-25-7-6-8-26(19-25)43-44(39,40)28-20-27-31(21-13-17-24(35)18-14-21)32(33(28)42-27)22-11-15-23(16-12-22)34-29(36)9-4-2-3-5-10-30(37)38/h6-8,11-19,27-28,33,35H,2-5,9-10,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094711 (CHEMBL3589352) Show SMILES Cc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)cc1 |c:15| Show InChI InChI=1S/C60H93N17O17S2/c1-4-31(2)48(63)59(93)75-42-30-96-95-29-41-51(85)66-27-47(82)76-23-9-13-43(76)58(92)70-37(11-5-7-21-61)52(86)71-38(25-33-15-17-34(79)18-16-33)54(88)73-40(28-78)55(89)68-35(49(64)83)19-20-46(81)65-22-8-6-12-36(69-56(42)90)53(87)72-39(26-45(62)80)60(94)77-24-10-14-44(77)57(91)67-32(3)50(84)74-41/h15-18,31-32,35-44,48,78-79H,4-14,19-30,61,63H2,1-3H3,(H2,62,80)(H2,64,83)(H,65,81)(H,66,85)(H,67,91)(H,68,89)(H,69,90)(H,70,92)(H,71,86)(H,72,87)(H,73,88)(H,74,84)(H,75,93)/t31-,32-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094744 (CHEMBL3589360) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(F)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32FNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	92	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094733 (CHEMBL3589356) Show SMILES Cc1ccccc1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(O)=O)cc1 |c:18| Show InChI InChI=1S/C33H35NO8S/c1-21-8-6-7-9-26(21)42-43(39,40)28-20-27-31(22-14-18-25(35)19-15-22)32(33(28)41-27)23-12-16-24(17-13-23)34-29(36)10-4-2-3-5-11-30(37)38/h6-9,12-19,27-28,33,35H,2-5,10-11,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	92	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094743 (CHEMBL3589359) Show SMILES COc1ccccc1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(O)=O)cc1 |c:19| Show InChI InChI=1S/C33H35NO9S/c1-41-25-8-6-7-9-26(25)43-44(39,40)28-20-27-31(21-14-18-24(35)19-15-21)32(33(28)42-27)22-12-16-23(17-13-22)34-29(36)10-4-2-3-5-11-30(37)38/h6-9,12-19,27-28,33,35H,2-5,10-11,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	95	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094738 (CHEMBL3589367) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1cccc2ccccc12)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C36H35NO8S/c38-27-20-16-24(17-21-27)34-30-22-31(46(42,43)45-29-11-7-9-23-8-5-6-10-28(23)29)36(44-30)35(34)25-14-18-26(19-15-25)37-32(39)12-3-1-2-4-13-33(40)41/h5-11,14-21,30-31,36,38H,1-4,12-13,22H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	101	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094750 (CHEMBL3589357) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1cccc(O)c1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-16-12-20(13-17-23)30-26-19-27(43(39,40)42-25-7-5-6-24(35)18-25)32(41-26)31(30)21-10-14-22(15-11-21)33-28(36)8-3-1-2-4-9-29(37)38/h5-7,10-18,26-27,32,34-35H,1-4,8-9,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	101	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094740 (CHEMBL3589701) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc2ccccc2c1)c1ccc(O)cc1 |t:20| Show InChI InChI=1S/C36H36N2O8S/c39-28-18-13-24(14-19-28)34-30-22-31(47(43,44)46-29-20-15-23-7-5-6-8-26(23)21-29)36(45-30)35(34)25-11-16-27(17-12-25)37-32(40)9-3-1-2-4-10-33(41)38-42/h5-8,11-21,30-31,36,39,42H,1-4,9-10,22H2,(H,37,40)(H,38,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	102	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094733 (CHEMBL3589356) Show SMILES Cc1ccccc1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(O)=O)cc1 |c:18| Show InChI InChI=1S/C33H35NO8S/c1-21-8-6-7-9-26(21)42-43(39,40)28-20-27-31(22-14-18-25(35)19-15-22)32(33(28)41-27)23-12-16-24(17-13-23)34-29(36)10-4-2-3-5-11-30(37)38/h6-9,12-19,27-28,33,35H,2-5,10-11,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	104	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094710 (CHEMBL3588865) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccccc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C55H84N16O16S4/c1-4-27(2)43(58)54(86)69-38-26-91-89-24-36-46(78)60-21-42(75)70-17-7-10-39(70)53(85)62-31(9-5-6-16-56)47(79)63-32(19-29-12-14-30(73)15-13-29)48(80)65-34(22-72)49(81)66-35(44(59)76)23-88-90-25-37(68-51(38)83)50(82)64-33(20-41(57)74)55(87)71-18-8-11-40(71)52(84)61-28(3)45(77)67-36/h12-15,27-28,31-40,43,72-73H,4-11,16-26,56,58H2,1-3H3,(H2,57,74)(H2,59,76)(H,60,78)(H,61,84)(H,62,85)(H,63,79)(H,64,82)(H,65,80)(H,66,81)(H,67,77)(H,68,83)(H,69,86)/t27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,43-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094734 (CHEMBL3589361) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccccc1O)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-17-13-20(14-18-23)30-26-19-27(43(39,40)42-25-8-6-5-7-24(25)35)32(41-26)31(30)21-11-15-22(16-12-21)33-28(36)9-3-1-2-4-10-29(37)38/h5-8,11-18,26-27,32,34-35H,1-4,9-10,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094738 (CHEMBL3589367) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1cccc2ccccc12)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C36H35NO8S/c38-27-20-16-24(17-21-27)34-30-22-31(46(42,43)45-29-11-7-9-23-8-5-6-10-28(23)29)36(44-30)35(34)25-14-18-26(19-15-25)37-32(39)12-3-1-2-4-13-33(40)41/h5-11,14-21,30-31,36,38H,1-4,12-13,22H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	122	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094752 (CHEMBL3589362) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(Cl)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32ClNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094735 (CHEMBL3589363) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(Br)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32BrNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094741 (CHEMBL3589351) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:27| Show InChI InChI=1S/C32H34N2O9S/c35-23-13-7-20(8-14-23)30-26-19-27(32(42-26)31(30)21-9-15-24(36)16-10-21)44(40,41)43-25-17-11-22(12-18-25)33-28(37)5-3-1-2-4-6-29(38)34-39/h7-18,26-27,32,35-36,39H,1-6,19H2,(H,33,37)(H,34,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	127	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094742 (CHEMBL3589358) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(O)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-13-9-20(10-14-23)30-26-19-27(43(39,40)42-25-17-15-24(35)16-18-25)32(41-26)31(30)21-7-11-22(12-8-21)33-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,34-35H,1-6,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	133	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094741 (CHEMBL3589351) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:27| Show InChI InChI=1S/C32H34N2O9S/c35-23-13-7-20(8-14-23)30-26-19-27(32(42-26)31(30)21-9-15-24(36)16-10-21)44(40,41)43-25-17-11-22(12-18-25)33-28(37)5-3-1-2-4-6-29(38)34-39/h7-18,26-27,32,35-36,39H,1-6,19H2,(H,33,37)(H,34,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	148	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094743 (CHEMBL3589359) Show SMILES COc1ccccc1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(O)=O)cc1 |c:19| Show InChI InChI=1S/C33H35NO9S/c1-41-25-8-6-7-9-26(25)43-44(39,40)28-20-27-31(21-14-18-24(35)19-15-21)32(33(28)42-27)22-12-16-23(17-13-22)34-29(36)10-4-2-3-5-11-30(37)38/h6-9,12-19,27-28,33,35H,2-5,10-11,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	159	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094739 (CHEMBL3589368) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc2ccccc2c1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C36H35NO8S/c38-28-18-13-24(14-19-28)34-30-22-31(46(42,43)45-29-20-15-23-7-5-6-8-26(23)21-29)36(44-30)35(34)25-11-16-27(17-12-25)37-32(39)9-3-1-2-4-10-33(40)41/h5-8,11-21,30-31,36,38H,1-4,9-10,22H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	169	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094711 (CHEMBL3589352) Show SMILES Cc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)cc1 |c:15| Show InChI InChI=1S/C60H93N17O17S2/c1-4-31(2)48(63)59(93)75-42-30-96-95-29-41-51(85)66-27-47(82)76-23-9-13-43(76)58(92)70-37(11-5-7-21-61)52(86)71-38(25-33-15-17-34(79)18-16-33)54(88)73-40(28-78)55(89)68-35(49(64)83)19-20-46(81)65-22-8-6-12-36(69-56(42)90)53(87)72-39(26-45(62)80)60(94)77-24-10-14-44(77)57(91)67-32(3)50(84)74-41/h15-18,31-32,35-44,48,78-79H,4-14,19-30,61,63H2,1-3H3,(H2,62,80)(H2,64,83)(H,65,81)(H,66,85)(H,67,91)(H,68,89)(H,69,90)(H,70,92)(H,71,86)(H,72,87)(H,73,88)(H,74,84)(H,75,93)/t31-,32-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	182	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094752 (CHEMBL3589362) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(Cl)cc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H32ClNO8S/c33-22-11-17-25(18-12-22)42-43(39,40)27-19-26-30(20-9-15-24(35)16-10-20)31(32(27)41-26)21-7-13-23(14-8-21)34-28(36)5-3-1-2-4-6-29(37)38/h7-18,26-27,32,35H,1-6,19H2,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094736 (CHEMBL3589364) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(cc1)C(F)(F)F)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C33H32F3NO8S/c34-33(35,36)22-11-17-25(18-12-22)45-46(42,43)27-19-26-30(20-9-15-24(38)16-10-20)31(32(27)44-26)21-7-13-23(14-8-21)37-28(39)5-3-1-2-4-6-29(40)41/h7-18,26-27,32,38H,1-6,19H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	256	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094740 (CHEMBL3589701) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc2ccccc2c1)c1ccc(O)cc1 |t:20| Show InChI InChI=1S/C36H36N2O8S/c39-28-18-13-24(14-19-28)34-30-22-31(47(43,44)46-29-20-15-23-7-5-6-8-26(23)21-29)36(45-30)35(34)25-11-16-27(17-12-25)37-32(40)9-3-1-2-4-10-33(41)38-42/h5-8,11-21,30-31,36,39,42H,1-4,9-10,22H2,(H,37,40)(H,38,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	307	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094737 (CHEMBL3589365) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccccc1C(F)(F)F)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C33H32F3NO8S/c34-33(35,36)24-7-5-6-8-25(24)45-46(42,43)27-19-26-30(20-13-17-23(38)18-14-20)31(32(27)44-26)21-11-15-22(16-12-21)37-28(39)9-3-1-2-4-10-29(40)41/h5-8,11-18,26-27,32,38H,1-4,9-10,19H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	479	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094722 (CHEMBL3589354) Show SMILES COc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)cc1 |c:16| Show InChI InChI=1S/C33H35NO9S/c1-41-25-16-18-26(19-17-25)43-44(39,40)28-20-27-31(21-10-14-24(35)15-11-21)32(33(28)42-27)22-8-12-23(13-9-22)34-29(36)6-4-2-3-5-7-30(37)38/h8-19,27-28,33,35H,2-7,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	618	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094747 (CHEMBL3589350) Show SMILES OC(=O)CCCCCCC(=O)Nc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)c1 |c:27| Show InChI InChI=1S/C32H33NO9S/c34-23-14-10-20(11-15-23)30-26-19-27(32(41-26)31(30)21-12-16-24(35)17-13-21)43(39,40)42-25-7-5-6-22(18-25)33-28(36)8-3-1-2-4-9-29(37)38/h5-7,10-18,26-27,32,34-35H,1-4,8-9,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094710 (CHEMBL3588865) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccccc1)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C55H84N16O16S4/c1-4-27(2)43(58)54(86)69-38-26-91-89-24-36-46(78)60-21-42(75)70-17-7-10-39(70)53(85)62-31(9-5-6-16-56)47(79)63-32(19-29-12-14-30(73)15-13-29)48(80)65-34(22-72)49(81)66-35(44(59)76)23-88-90-25-37(68-51(38)83)50(82)64-33(20-41(57)74)55(87)71-18-8-11-40(71)52(84)61-28(3)45(77)67-36/h12-15,27-28,31-40,43,72-73H,4-11,16-26,56,58H2,1-3H3,(H2,57,74)(H2,59,76)(H,60,78)(H,61,84)(H,62,85)(H,63,79)(H,64,82)(H,65,80)(H,66,81)(H,67,77)(H,68,83)(H,69,86)/t27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,43-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	654	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094708 (CHEMBL3589347) Show SMILES COC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:27| Show InChI InChI=1S/C40H48N2O6/c1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h9-14,21-24,31-32H,15-20H2,1-8H3/q+2/t31-,32+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	756	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094709 (CHEMBL3589349) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)cc1 |c:26| Show InChI InChI=1S/C60H93N17O17S2.C40H48N2O6/c1-4-31(2)48(63)59(93)75-42-30-96-95-29-41-51(85)66-27-47(82)76-23-9-13-43(76)58(92)70-36(12-5-7-21-61)52(86)71-38(25-33-15-17-34(79)18-16-33)54(88)73-40(28-78)55(89)68-35(49(64)83)11-6-8-22-65-46(81)20-19-37(69-56(42)90)53(87)72-39(26-45(62)80)60(94)77-24-10-14-44(77)57(91)67-32(3)50(84)74-41;1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h15-18,31-32,35-44,48,78-79H,4-14,19-30,61,63H2,1-3H3,(H2,62,80)(H2,64,83)(H,65,81)(H,66,85)(H,67,91)(H,68,89)(H,69,90)(H,70,92)(H,71,86)(H,72,87)(H,73,88)(H,74,84)(H,75,93);9-14,21-24,31-32H,15-20H2,1-8H3/q;+2/t31-,32-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,48-;31-,32+/m00/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	773	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094760 (CHEMBL3589700) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1cccc2ccccc12)c1ccc(O)cc1 |t:20| Show InChI InChI=1S/C36H36N2O8S/c39-27-20-16-24(17-21-27)34-30-22-31(47(43,44)46-29-11-7-9-23-8-5-6-10-28(23)29)36(45-30)35(34)25-14-18-26(19-15-25)37-32(40)12-3-1-2-4-13-33(41)38-42/h5-11,14-21,30-31,36,39,42H,1-4,12-13,22H2,(H,37,40)(H,38,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	810	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094753 (CHEMBL3589366) Show SMILES Cc1cccc(C)c1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(O)=O)cc1 |c:19| Show InChI InChI=1S/C34H37NO8S/c1-21-8-7-9-22(2)33(21)43-44(40,41)28-20-27-31(23-14-18-26(36)19-15-23)32(34(28)42-27)24-12-16-25(17-13-24)35-29(37)10-5-3-4-6-11-30(38)39/h7-9,12-19,27-28,34,36H,3-6,10-11,20H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	971	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094734 (CHEMBL3589361) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccccc1O)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C32H33NO9S/c34-23-17-13-20(14-18-23)30-26-19-27(43(39,40)42-25-8-6-5-7-24(25)35)32(41-26)31(30)21-11-15-22(16-12-21)33-28(36)9-3-1-2-4-10-29(37)38/h5-8,11-18,26-27,32,34-35H,1-4,9-10,19H2,(H,33,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094746 (CHEMBL3589348) Show SMILES COC(=O)CCCCCCC(=O)Nc1cccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(O)cc2)c1 |c:28| Show InChI InChI=1S/C33H35NO9S/c1-41-30(38)10-5-3-2-4-9-29(37)34-23-7-6-8-26(19-23)43-44(39,40)28-20-27-31(21-11-15-24(35)16-12-21)32(33(28)42-27)22-13-17-25(36)18-14-22/h6-8,11-19,27-28,33,35-36H,2-5,9-10,20H2,1H3,(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094736 (CHEMBL3589364) Show SMILES OC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(cc1)C(F)(F)F)c1ccc(O)cc1 |t:19| Show InChI InChI=1S/C33H32F3NO8S/c34-33(35,36)22-11-17-25(18-12-22)45-46(42,43)27-19-26-30(20-9-15-24(38)16-10-20)31(32(27)44-26)21-7-13-23(14-8-21)37-28(39)5-3-1-2-4-6-29(40)41/h7-18,26-27,32,38H,1-6,19H2,(H,37,39)(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.72E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094756 (CHEMBL3589696) Show SMILES Cc1ccccc1OS(=O)(=O)C1CC2OC1C(=C2c1ccc(O)cc1)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 |c:18| Show InChI InChI=1S/C33H36N2O8S/c1-21-8-6-7-9-26(21)43-44(40,41)28-20-27-31(22-14-18-25(36)19-15-22)32(33(28)42-27)23-12-16-24(17-13-23)34-29(37)10-4-2-3-5-11-30(38)35-39/h6-9,12-19,27-28,33,36,39H,2-5,10-11,20H2,1H3,(H,34,37)(H,35,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50094722 (CHEMBL3589354) Show SMILES COc1ccc(OS(=O)(=O)C2CC3OC2C(=C3c2ccc(O)cc2)c2ccc(NC(=O)CCCCCCC(O)=O)cc2)cc1 |c:16| Show InChI InChI=1S/C33H35NO9S/c1-41-25-16-18-26(19-17-25)43-44(39,40)28-20-27-31(21-10-14-24(35)15-11-21)32(33(28)42-27)22-8-12-23(13-9-22)34-29(36)6-4-2-3-5-7-30(37)38/h8-19,27-28,33,35H,2-7,20H2,1H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-alpha ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50094759 (CHEMBL3589699) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C1=C(C2CC(C1O2)S(=O)(=O)Oc1ccc(Br)cc1)c1ccc(O)cc1 |t:20| Show InChI InChI=1S/C32H33BrN2O8S/c33-22-11-17-25(18-12-22)43-44(40,41)27-19-26-30(20-9-15-24(36)16-10-20)31(32(27)42-26)21-7-13-23(14-8-21)34-28(37)5-3-1-2-4-6-29(38)35-39/h7-18,26-27,32,36,39H,1-6,19H2,(H,34,37)(H,35,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.43E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University) Curated by ChEMBL					Assay Description Binding affinity to human ER-beta ligand binding domain after 2 hrs by competitive fluorometric binding assay				J Med Chem 58: 4550-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00099 BindingDB Entry DOI: 10.7270/Q2Z321CF
					More data for this Ligand-Target Pair

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