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PubMed code 9003514

Compile data set for download or QSAR
Found 73 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Estrogen receptor beta


(Homo sapiens (Human))		BDBM19441
PNG
(2-(4-hydroxyphenyl)-3-({4-[2-(piperidin-1-yl)ethox...)
Show SMILES Oc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2
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n/an/a 0.200n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471357
PNG
(CHEMBL48021)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C28H26FNO4S/c29-23-16-19(6-11-24(23)32)28-26(22-10-7-20(31)17-25(22)35-28)27(33)18-4-8-21(9-5-18)34-15-14-30-12-2-1-3-13-30/h4-11,16-17,31-32H,1-3,12-15H2
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n/an/a 0.300n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50276802
PNG
(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-
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471380
PNG
(CHEMBL44492)
Show SMILES Cc1ccccc1-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO3S/c1-20-7-3-4-8-24(20)29-27(25-14-11-22(31)19-26(25)34-29)28(32)21-9-12-23(13-10-21)33-18-17-30-15-5-2-6-16-30/h3-4,7-14,19,31H,2,5-6,15-18H2,1H3
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n/an/a 0.700n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471370
PNG
(CHEMBL44940)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1cccc2ccccc12
Show InChI InChI=1S/C32H29NO3S/c34-24-13-16-28-29(21-24)37-32(27-10-6-8-22-7-2-3-9-26(22)27)30(28)31(35)23-11-14-25(15-12-23)36-20-19-33-17-4-1-5-18-33/h2-3,6-16,21,34H,1,4-5,17-20H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215104
PNG
(CHEMBL43779)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(cc1)C#C
Show InChI InChI=1S/C30H27NO3S/c1-2-21-6-8-23(9-7-21)30-28(26-15-12-24(32)20-27(26)35-30)29(33)22-10-13-25(14-11-22)34-19-18-31-16-4-3-5-17-31/h1,6-15,20,32H,3-5,16-19H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50276893
PNG
(CHEMBL1193539)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H26ClNO3S/c29-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-30-14-2-1-3-15-30/h4-13,18,31H,1-3,14-17H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471377
PNG
(CHEMBL43775)
Show SMILES Cc1cc(ccc1O)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO4S/c1-19-17-21(7-12-25(19)32)29-27(24-11-8-22(31)18-26(24)35-29)28(33)20-5-9-23(10-6-20)34-16-15-30-13-3-2-4-14-30/h5-12,17-18,31-32H,2-4,13-16H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471392
PNG
(CHEMBL48079)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)c2ccccc12
Show InChI InChI=1S/C32H29NO4S/c34-22-10-13-27-29(20-22)38-32(26-14-15-28(35)25-7-3-2-6-24(25)26)30(27)31(36)21-8-11-23(12-9-21)37-19-18-33-16-4-1-5-17-33/h2-3,6-15,20,34-35H,1,4-5,16-19H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471382
PNG
(CHEMBL64692)
Show SMILES O[C@H]1CC[C@@H](CC1)c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1 |wU:4.7,wD:1.0,(21.83,-10.84,;20.31,-10.91,;19.49,-9.51,;17.97,-9.57,;17.23,-10.91,;18,-12.22,;19.51,-12.22,;15.66,-10.91,;14.77,-12.19,;13.28,-11.74,;11.97,-12.51,;10.59,-11.74,;9.27,-12.52,;10.59,-10.2,;11.9,-9.41,;13.25,-10.15,;14.73,-9.7,;15.21,-8.18,;16.72,-7.89,;14.15,-7.09,;14.61,-5.61,;13.57,-4.47,;12.06,-4.81,;11,-3.69,;9.5,-4.01,;8.45,-2.89,;6.94,-3.21,;5.9,-2.09,;4.4,-2.41,;3.91,-3.89,;5,-4.97,;6.48,-4.69,;11.58,-6.29,;12.65,-7.38,)|
Show InChI InChI=1S/C28H33NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h6-7,10-13,18,20-21,30-31H,1-5,8-9,14-17H2/t20-,21-
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471367
PNG
(CHEMBL44158)
Show SMILES COc1cc(O)ccc1-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO5S/c1-34-25-17-20(31)7-11-23(25)29-27(24-12-8-21(32)18-26(24)36-29)28(33)19-5-9-22(10-6-19)35-16-15-30-13-3-2-4-14-30/h5-12,17-18,31-32H,2-4,13-16H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471394
PNG
(CHEMBL44633)
Show SMILES Cc1cc(O)ccc1-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO4S/c1-19-17-21(31)7-11-24(19)29-27(25-12-8-22(32)18-26(25)35-29)28(33)20-5-9-23(10-6-20)34-16-15-30-13-3-2-4-14-30/h5-12,17-18,31-32H,2-4,13-16H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471374
PNG
(CHEMBL47821)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)c(Cl)c1
Show InChI InChI=1S/C28H26ClNO4S/c29-23-16-19(6-11-24(23)32)28-26(22-10-7-20(31)17-25(22)35-28)27(33)18-4-8-21(9-5-18)34-15-14-30-12-2-1-3-13-30/h4-11,16-17,31-32H,1-3,12-15H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471384
PNG
(CHEMBL540790)
Show SMILES Cl.Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H26FNO3S/c29-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-30-14-2-1-3-15-30/h4-13,18,31H,1-3,14-17H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471372
PNG
(CHEMBL295111)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1cccc(F)c1
Show InChI InChI=1S/C28H26FNO3S/c29-21-6-4-5-20(17-21)28-26(24-12-9-22(31)18-25(24)34-28)27(32)19-7-10-23(11-8-19)33-16-15-30-13-2-1-3-14-30/h4-12,17-18,31H,1-3,13-16H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471383
PNG
(CHEMBL556034)
Show SMILES Cl.Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccccc1
Show InChI InChI=1S/C28H27NO3S/c30-22-11-14-24-25(19-22)33-28(21-7-3-1-4-8-21)26(24)27(31)20-9-12-23(13-10-20)32-18-17-29-15-5-2-6-16-29/h1,3-4,7-14,19,30H,2,5-6,15-18H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471362
PNG
(CHEMBL47944)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)C1CCCCC1
Show InChI InChI=1S/C28H33NO3S/c30-22-11-14-24-25(19-22)33-28(21-7-3-1-4-8-21)26(24)27(31)20-9-12-23(13-10-20)32-18-17-29-15-5-2-6-16-29/h9-14,19,21,30H,1-8,15-18H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471366
PNG
(CHEMBL296875)
Show SMILES CC(C)c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C25H29NO3S/c1-17(2)25-23(21-11-8-19(27)16-22(21)30-25)24(28)18-6-9-20(10-7-18)29-15-14-26-12-4-3-5-13-26/h6-11,16-17,27H,3-5,12-15H2,1-2H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471355
PNG
(CHEMBL47358)
Show SMILES Oc1ccc(cc1)-c1sc2cc(O)c(F)cc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H26FNO4S/c29-23-16-22-25(17-24(23)32)35-28(19-4-8-20(31)9-5-19)26(22)27(33)18-6-10-21(11-7-18)34-15-14-30-12-2-1-3-13-30/h4-11,16-17,31-32H,1-3,12-15H2
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n/an/a 3n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471396
PNG
(CHEMBL295903)
Show SMILES Oc1cccc(c1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO4S/c30-21-6-4-5-20(17-21)28-26(24-12-9-22(31)18-25(24)34-28)27(32)19-7-10-23(11-8-19)33-16-15-29-13-2-1-3-14-29/h4-12,17-18,30-31H,1-3,13-16H2
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n/an/a 3.20n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471403
PNG
(CHEMBL44812)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)C1CCCC1
Show InChI InChI=1S/C27H31NO3S/c29-21-10-13-23-24(18-21)32-27(20-6-2-3-7-20)25(23)26(30)19-8-11-22(12-9-19)31-17-16-28-14-4-1-5-15-28/h8-13,18,20,29H,1-7,14-17H2
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n/an/a 5n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471387
PNG
(CHEMBL47012)
Show SMILES Oc1ccc(Cc2sc3cc(O)ccc3c2C(=O)c2ccc(OCCN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C29H29NO4S/c31-22-8-4-20(5-9-22)18-27-28(25-13-10-23(32)19-26(25)35-27)29(33)21-6-11-24(12-7-21)34-17-16-30-14-2-1-3-15-30/h4-13,19,31-32H,1-3,14-18H2
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n/an/a 5n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471385
PNG
(CHEMBL416810)
Show SMILES CCc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H31NO3S/c1-2-21-6-8-23(9-7-21)30-28(26-15-12-24(32)20-27(26)35-30)29(33)22-10-13-25(14-11-22)34-19-18-31-16-4-3-5-17-31/h6-15,20,32H,2-5,16-19H2,1H3
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n/an/a 5n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215164
PNG
(CHEMBL297549)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(C=C)cc1
Show InChI InChI=1S/C30H29NO3S/c1-2-21-6-8-23(9-7-21)30-28(26-15-12-24(32)20-27(26)35-30)29(33)22-10-13-25(14-11-22)34-19-18-31-16-4-3-5-17-31/h2,6-15,20,32H,1,3-5,16-19H2
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n/an/a 7n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471361
PNG
(CHEMBL46806)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccccc1O
Show InChI InChI=1S/C28H27NO4S/c30-20-10-13-23-25(18-20)34-28(22-6-2-3-7-24(22)31)26(23)27(32)19-8-11-21(12-9-19)33-17-16-29-14-4-1-5-15-29/h2-3,6-13,18,30-31H,1,4-5,14-17H2
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n/an/a 10n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471388
PNG
(CHEMBL46408)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccsc1
Show InChI InChI=1S/C26H25NO3S2/c28-20-6-9-22-23(16-20)32-26(19-10-15-31-17-19)24(22)25(29)18-4-7-21(8-5-18)30-14-13-27-11-2-1-3-12-27/h4-10,15-17,28H,1-3,11-14H2
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n/an/a 10n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50055569
PNG
(CHEMBL46937 | [2-(4-Butyl-phenyl)-6-hydroxy-benzo[...)
Show SMILES CCCCc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C32H35NO3S/c1-2-3-7-23-8-10-25(11-9-23)32-30(28-17-14-26(34)22-29(28)37-32)31(35)24-12-15-27(16-13-24)36-21-20-33-18-5-4-6-19-33/h8-17,22,34H,2-7,18-21H2,1H3
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n/an/a 10n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215252
PNG
(CHEMBL47811)
Show SMILES Oc1ccc(cc1)-c1sc2cc(ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1)C#C
Show InChI InChI=1S/C30H27NO3S/c1-2-21-6-15-26-27(20-21)35-30(23-7-11-24(32)12-8-23)28(26)29(33)22-9-13-25(14-10-22)34-19-18-31-16-4-3-5-17-31/h1,6-15,20,32H,3-5,16-19H2
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n/an/a 20n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471407
PNG
(CHEMBL46409)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1cccs1
Show InChI InChI=1S/C26H25NO3S2/c28-19-8-11-21-23(17-19)32-26(22-5-4-16-31-22)24(21)25(29)18-6-9-20(10-7-18)30-15-14-27-12-2-1-3-13-27/h4-11,16-17,28H,1-3,12-15H2
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n/an/a 20n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471386
PNG
(CHEMBL47247)
Show SMILES CCc1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C24H27NO3S/c1-2-21-23(20-11-8-18(26)16-22(20)29-21)24(27)17-6-9-19(10-7-17)28-15-14-25-12-4-3-5-13-25/h6-11,16,26H,2-5,12-15H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215248
PNG
(CHEMBL46921)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C31H32N2O4S/c1-32(2)31(36)23-8-6-22(7-9-23)30-28(26-15-12-24(34)20-27(26)38-30)29(35)21-10-13-25(14-11-21)37-19-18-33-16-4-3-5-17-33/h6-15,20,34H,3-5,16-19H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215256
PNG
(CHEMBL169162)
Show SMILES COC(=O)c1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C30H29NO5S/c1-35-30(34)22-9-14-25-26(19-22)37-29(21-5-10-23(32)11-6-21)27(25)28(33)20-7-12-24(13-8-20)36-18-17-31-15-3-2-4-16-31/h5-14,19,32H,2-4,15-18H2,1H3
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n/an/a 30n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215102
PNG
(CHEMBL297782)
Show SMILES NC(=O)c1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C29H28N2O4S/c30-29(34)21-8-13-24-25(18-21)36-28(20-4-9-22(32)10-5-20)26(24)27(33)19-6-11-23(12-7-19)35-17-16-31-14-2-1-3-15-31/h4-13,18,32H,1-3,14-17H2,(H2,30,34)
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n/an/a 30n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471358
PNG
(CHEMBL47553)
Show SMILES CC(C)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C31H33NO3S/c1-21(2)22-6-8-24(9-7-22)31-29(27-15-12-25(33)20-28(27)36-31)30(34)23-10-13-26(14-11-23)35-19-18-32-16-4-3-5-17-32/h6-15,20-21,33H,3-5,16-19H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215099
PNG
(CHEMBL416088)
Show SMILES CC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H29NO4S/c1-20(32)21-5-7-23(8-6-21)30-28(26-14-11-24(33)19-27(26)36-30)29(34)22-9-12-25(13-10-22)35-18-17-31-15-3-2-4-16-31/h5-14,19,33H,2-4,15-18H2,1H3
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n/an/a 32n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471381
PNG
(CHEMBL43936)
Show SMILES Cc1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C23H25NO3S/c1-16-22(20-10-7-18(25)15-21(20)28-16)23(26)17-5-8-19(9-6-17)27-14-13-24-11-3-2-4-12-24/h5-10,15,25H,2-4,11-14H2,1H3
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n/an/a 35n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471379
PNG
(CHEMBL538492)
Show SMILES Cl.Oc1ccc(cc1)-c1sc2ccccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO3S/c30-22-12-8-21(9-13-22)28-26(24-6-2-3-7-25(24)33-28)27(31)20-10-14-23(15-11-20)32-19-18-29-16-4-1-5-17-29/h2-3,6-15,30H,1,4-5,16-19H2
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n/an/a 35n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215100
PNG
(CHEMBL170884)
Show SMILES CNC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H30N2O4S/c1-31-30(35)22-7-5-21(6-8-22)29-27(25-14-11-23(33)19-26(25)37-29)28(34)20-9-12-24(13-10-20)36-18-17-32-15-3-2-4-16-32/h5-14,19,33H,2-4,15-18H2,1H3,(H,31,35)
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n/an/a 40n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215249
PNG
(CHEMBL47217)
Show SMILES CCOC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C31H31NO5S/c1-2-36-31(35)23-8-6-22(7-9-23)30-28(26-15-12-24(33)20-27(26)38-30)29(34)21-10-13-25(14-11-21)37-19-18-32-16-4-3-5-17-32/h6-15,20,33H,2-5,16-19H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471397
PNG
(CHEMBL544251)
Show SMILES Cl.Cc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO3S/c1-20-5-7-22(8-6-20)29-27(25-14-11-23(31)19-26(25)34-29)28(32)21-9-12-24(13-10-21)33-18-17-30-15-3-2-4-16-30/h5-14,19,31H,2-4,15-18H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215103
PNG
(CHEMBL297996)
Show SMILES COC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H29NO5S/c1-35-30(34)22-7-5-21(6-8-22)29-27(25-14-11-23(32)19-26(25)37-29)28(33)20-9-12-24(13-10-20)36-18-17-31-15-3-2-4-16-31/h5-14,19,32H,2-4,15-18H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215241
PNG
(CHEMBL297813)
Show SMILES CC(=O)c1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C30H29NO4S/c1-20(32)23-9-14-26-27(19-23)36-30(22-5-10-24(33)11-6-22)28(26)29(34)21-7-12-25(13-8-21)35-18-17-31-15-3-2-4-16-31/h5-14,19,33H,2-4,15-18H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471406
PNG
(CHEMBL296226)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc2ccccc2c1
Show InChI InChI=1S/C32H29NO3S/c34-26-12-15-28-29(21-26)37-32(25-9-8-22-6-2-3-7-24(22)20-25)30(28)31(35)23-10-13-27(14-11-23)36-19-18-33-16-4-1-5-17-33/h2-3,6-15,20-21,34H,1,4-5,16-19H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471359
PNG
(CHEMBL42018)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccncc1
Show InChI InChI=1S/C27H26N2O3S/c30-21-6-9-23-24(18-21)33-27(20-10-12-28-13-11-20)25(23)26(31)19-4-7-22(8-5-19)32-17-16-29-14-2-1-3-15-29/h4-13,18,30H,1-3,14-17H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471360
PNG
(CHEMBL44797)
Show SMILES Cc1cc(cc(C)c1O)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H31NO4S/c1-19-16-22(17-20(2)28(19)33)30-27(25-11-8-23(32)18-26(25)36-30)29(34)21-6-9-24(10-7-21)35-15-14-31-12-4-3-5-13-31/h6-11,16-18,32-33H,3-5,12-15H2,1-2H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471405
PNG
(CHEMBL295907)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C34H31NO3S/c36-28-15-18-30-31(23-28)39-34(27-11-9-25(10-12-27)24-7-3-1-4-8-24)32(30)33(37)26-13-16-29(17-14-26)38-22-21-35-19-5-2-6-20-35/h1,3-4,7-18,23,36H,2,5-6,19-22H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471364
PNG
(CHEMBL44634)
Show SMILES Oc1ccc(cc1)-c1sc2ccc(O)cc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-18-22(31)10-13-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471389
PNG
(CHEMBL1160091)
Show SMILES OC(=O)CC(O)(CC(O)=O)C(O)=O.COc1ccc(cc1)-c1sc2ccccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO3S/c1-32-23-13-11-22(12-14-23)29-27(25-7-3-4-8-26(25)34-29)28(31)21-9-15-24(16-10-21)33-20-19-30-17-5-2-6-18-30/h3-4,7-16H,2,5-6,17-20H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471401
PNG
(CHEMBL45120)
Show SMILES CCSCc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C31H33NO3S2/c1-2-36-21-22-6-8-24(9-7-22)31-29(27-15-12-25(33)20-28(27)37-31)30(34)23-10-13-26(14-11-23)35-19-18-32-16-4-3-5-17-32/h6-15,20,33H,2-5,16-19,21H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471398
PNG
(CHEMBL44643)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1cc[n+]([O-])cc1
Show InChI InChI=1S/C27H26N2O4S/c30-21-6-9-23-24(18-21)34-27(20-10-14-29(32)15-11-20)25(23)26(31)19-4-7-22(8-5-19)33-17-16-28-12-2-1-3-13-28/h4-11,14-15,18,30H,1-3,12-13,16-17H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471371
PNG
(CHEMBL296759)
Show SMILES Cc1cc(O)c(C)c2sc(c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c12)-c1ccc(O)cc1
Show InChI InChI=1S/C30H31NO4S/c1-19-18-25(33)20(2)29-26(19)27(30(36-29)22-6-10-23(32)11-7-22)28(34)21-8-12-24(13-9-21)35-17-16-31-14-4-3-5-15-31/h6-13,18,32-33H,3-5,14-17H2,1-2H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50276884
PNG
(CHEMBL42707)
Show SMILES Oc1ccc(cc1)-c1sc2cccc(O)c2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO4S/c30-21-11-7-20(8-12-21)28-26(25-23(31)5-4-6-24(25)34-28)27(32)19-9-13-22(14-10-19)33-18-17-29-15-2-1-3-16-29/h4-14,30-31H,1-3,15-18H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215163
PNG
(CHEMBL416268)
Show SMILES NC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H28N2O4S/c30-29(34)21-6-4-20(5-7-21)28-26(24-13-10-22(32)18-25(24)36-28)27(33)19-8-11-23(12-9-19)35-17-16-31-14-2-1-3-15-31/h4-13,18,32H,1-3,14-17H2,(H2,30,34)
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215255
PNG
(CHEMBL45107)
Show SMILES CCOP(=O)(OCC)c1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C32H36NO6PS/c1-3-38-40(36,39-4-2)27-16-17-28-29(22-27)41-32(24-8-12-25(34)13-9-24)30(28)31(35)23-10-14-26(15-11-23)37-21-20-33-18-6-5-7-19-33/h8-17,22,34H,3-7,18-21H2,1-2H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215250
PNG
(CHEMBL297830)
Show SMILES CCOP(=O)(OCC)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C32H36NO6PS/c1-3-38-40(36,39-4-2)27-15-10-24(11-16-27)32-30(28-17-12-25(34)22-29(28)41-32)31(35)23-8-13-26(14-9-23)37-21-20-33-18-6-5-7-19-33/h8-17,22,34H,3-7,18-21H2,1-2H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471376
PNG
(CHEMBL47464)
Show SMILES COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C29H29NO4S/c1-33-24-13-14-25-26(19-24)35-29(21-5-9-22(31)10-6-21)27(25)28(32)20-7-11-23(12-8-20)34-18-17-30-15-3-2-4-16-30/h5-14,19,31H,2-4,15-18H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471373
PNG
(CHEMBL542353)
Show SMILES Cl.Cc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C29H29NO3S/c1-20-5-14-25-26(19-20)34-29(22-6-10-23(31)11-7-22)27(25)28(32)21-8-12-24(13-9-21)33-18-17-30-15-3-2-4-16-30/h5-14,19,31H,2-4,15-18H2,1H3
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471391
PNG
(CHEMBL44701)
Show SMILES Oc1ccc(cc1)-c1sc2c(O)cccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO4S/c30-21-11-7-20(8-12-21)27-25(23-5-4-6-24(31)28(23)34-27)26(32)19-9-13-22(14-10-19)33-18-17-29-15-2-1-3-16-29/h4-14,30-31H,1-3,15-18H2
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Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471368
PNG
(CHEMBL555102)
Show SMILES Cl.COc1ccc(cc1)-c1sc2cc(OC)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H31NO4S/c1-33-23-10-8-22(9-11-23)30-28(26-15-14-25(34-2)20-27(26)36-30)29(32)21-6-12-24(13-7-21)35-19-18-31-16-4-3-5-17-31/h6-15,20H,3-5,16-19H2,1-2H3
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n/an/a 300n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471402
PNG
(CHEMBL538986)
Show SMILES Cl.O=C(c1c(sc2ccccc12)-c1ccccc1)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO2S/c30-27(21-13-15-23(16-14-21)31-20-19-29-17-7-2-8-18-29)26-24-11-5-6-12-25(24)32-28(26)22-9-3-1-4-10-22/h1,3-6,9-16H,2,7-8,17-20H2
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n/an/a 300n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50215247
PNG
(CHEMBL295540)
Show SMILES OC(=O)c1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H27NO5S/c31-22-10-13-24-25(18-22)36-28(20-4-6-21(7-5-20)29(33)34)26(24)27(32)19-8-11-23(12-9-19)35-17-16-30-14-2-1-3-15-30/h4-13,18,31H,1-3,14-17H2,(H,33,34)
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n/an/a 325n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471375
PNG
(CHEMBL431141)
Show SMILES Oc1ccc(cc1)-c1sc2cc(O)cc(O)c2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO5S/c30-20-8-4-19(5-9-20)28-26(25-23(32)16-21(31)17-24(25)35-28)27(33)18-6-10-22(11-7-18)34-15-14-29-12-2-1-3-13-29/h4-11,16-17,30-32H,1-3,12-15H2
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n/an/a 350n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471400
PNG
(CHEMBL555783)
Show SMILES Cl.COc1ccc(cc1)-c1sc2c(OC)c(OC)c(OC)cc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C32H35NO6S/c1-35-23-12-10-22(11-13-23)31-27(25-20-26(36-2)29(37-3)30(38-4)32(25)40-31)28(34)21-8-14-24(15-9-21)39-19-18-33-16-6-5-7-17-33/h8-15,20H,5-7,16-19H2,1-4H3
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n/an/a 350n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471378
PNG
(CHEMBL46982)
Show SMILES Oc1ccc(cc1)-c1sc2cc(O)c(O)cc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H27NO5S/c30-20-8-4-19(5-9-20)28-26(22-16-23(31)24(32)17-25(22)35-28)27(33)18-6-10-21(11-7-18)34-15-14-29-12-2-1-3-13-29/h4-11,16-17,30-32H,1-3,12-15H2
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n/an/a 400n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471395
PNG
(CHEMBL45386)
Show SMILES Cc1cc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c(C)c1O)-c1ccc(O)cc1
Show InChI InChI=1S/C30H31NO4S/c1-19-18-25-26(30(22-6-10-23(32)11-7-22)36-29(25)20(2)27(19)33)28(34)21-8-12-24(13-9-21)35-17-16-31-14-4-3-5-15-31/h6-13,18,32-33H,3-5,14-17H2,1-2H3
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n/an/a 500n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471399
PNG
(CHEMBL297052)
Show SMILES Oc1ccc(cc1)-c1sc2cc(O)c3ccccc3c2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C32H29NO4S/c34-23-12-8-22(9-13-23)32-30(29-26-7-3-2-6-25(26)27(35)20-28(29)38-32)31(36)21-10-14-24(15-11-21)37-19-18-33-16-4-1-5-17-33/h2-3,6-15,20,34-35H,1,4-5,16-19H2
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n/an/a 500n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471390
PNG
(CHEMBL296526)
Show SMILES COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc2OCOc2c1
Show InChI InChI=1S/C30H29NO5S/c1-33-23-10-11-24-27(18-23)37-30(21-7-12-25-26(17-21)36-19-35-25)28(24)29(32)20-5-8-22(9-6-20)34-16-15-31-13-3-2-4-14-31/h5-12,17-18H,2-4,13-16,19H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471393
PNG
(CHEMBL47087)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C28H26N2O5S/c31-22-10-13-24-25(18-22)36-28(20-4-8-21(9-5-20)30(33)34)26(24)27(32)19-6-11-23(12-7-19)35-17-16-29-14-2-1-3-15-29/h4-13,18,31H,1-3,14-17H2
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n/an/a 500n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471356
PNG
(CHEMBL46622)
Show SMILES COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(CO)cc1
Show InChI InChI=1S/C30H31NO4S/c1-34-25-13-14-26-27(19-25)36-30(23-7-5-21(20-32)6-8-23)28(26)29(33)22-9-11-24(12-10-22)35-18-17-31-15-3-2-4-16-31/h5-14,19,32H,2-4,15-18,20H2,1H3
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n/an/a 600n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471404
PNG
(CHEMBL44792)
Show SMILES COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccccc1
Show InChI InChI=1S/C29H29NO3S/c1-32-24-14-15-25-26(20-24)34-29(22-8-4-2-5-9-22)27(25)28(31)21-10-12-23(13-11-21)33-19-18-30-16-6-3-7-17-30/h2,4-5,8-15,20H,3,6-7,16-19H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471369
PNG
(CHEMBL264302)
Show SMILES COc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C29H29NO4S/c1-33-23-10-7-21(8-11-23)29-27(25-14-9-22(31)19-26(25)35-29)28(32)20-5-12-24(13-6-20)34-18-17-30-15-3-2-4-16-30/h5-14,19,31H,2-4,15-18H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471363
PNG
(CHEMBL46626)
Show SMILES Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(sc2c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H26F3NO3S/c30-29(31,32)21-8-4-20(5-9-21)28-26(24-13-10-22(34)18-25(24)37-28)27(35)19-6-11-23(12-7-19)36-17-16-33-14-2-1-3-15-33/h4-13,18,34H,1-3,14-17H2
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n/an/a 1.00E+3n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50471365
PNG
(CHEMBL544727)
Show SMILES Cl.Oc1ccc(cc1)-c1sc2cc(Cl)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C28H26ClNO3S/c29-21-8-13-24-25(18-21)34-28(20-4-9-22(31)10-5-20)26(24)27(32)19-6-11-23(12-7-19)33-17-16-30-14-2-1-3-15-30/h4-13,18,31H,1-3,14-17H2
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n/an/a 1.00E+3n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Antagonism of estrogen action in a mammary tumor cell line was assayed via inhibition of MCF-7 cell proliferation stimulated by 10 e-11 M 17-beta-est...

J Med Chem 40: 146-67 (1997)


Article DOI: 10.1021/jm9606352
BindingDB Entry DOI: 10.7270/Q2PZ5CKJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%