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PubMed code 17459530

Compile data set for download or QSAR
Found 103 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))		BDBM50154137
PNG
(3-(6-HYDROXY-NAPHTHALEN-2-YL)-BENZO[D]ISOOXAZOL-6-...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc2cc(O)ccc2c1
Show InChI InChI=1S/C17H11NO3/c19-13-4-3-10-7-12(2-1-11(10)8-13)17-15-6-5-14(20)9-16(15)21-18-17/h1-9,19-20H
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n/an/a 1.40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242647
PNG
(7-bromo-2-(4-hydroxy-2-(trifluoromethyl)phenyl)ben...)
Show SMILES Oc1ccc(-c2nc3cc(O)cc(Br)c3o2)c(c1)C(F)(F)F
Show InChI InChI=1S/C14H7BrF3NO3/c15-10-4-7(21)5-11-12(10)22-13(19-11)8-2-1-6(20)3-9(8)14(16,17)18/h1-5,20-21H
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n/an/a 1.40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154088
PNG
(7-Bromo-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 7-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(Br)c2o1
Show InChI InChI=1S/C13H8BrNO3/c14-10-5-9(17)6-11-12(10)18-13(15-11)7-1-3-8(16)4-2-7/h1-6,16-17H
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n/an/a 1.40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154088
PNG
(7-Bromo-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 7-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(Br)c2o1
Show InChI InChI=1S/C13H8BrNO3/c14-10-5-9(17)6-11-12(10)18-13(15-11)7-1-3-8(16)4-2-7/h1-6,16-17H
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n/an/a 1.40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154048
PNG
(3-(5-Hydroxy-naphthalen-1-yl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1cccc2c(O)cccc12
Show InChI InChI=1S/C17H11NO3/c19-10-7-8-14-16(9-10)21-18-17(14)13-5-1-4-12-11(13)3-2-6-15(12)20/h1-9,19-20H
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n/an/a 1.5n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM20731
PNG
(4-bromo-6-(6-hydroxy-1,2-benzoxazol-3-yl)benzene-1...)
Show SMILES Oc1ccc2c(noc2c1)-c1cc(Br)c(O)cc1O
Show InChI InChI=1S/C13H8BrNO4/c14-9-4-8(10(17)5-11(9)18)13-7-2-1-6(16)3-12(7)19-15-13/h1-5,16-18H
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n/an/a 1.80n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM20734
PNG
(4-chloro-6-(6-hydroxy-1,2-benzoxazol-3-yl)benzene-...)
Show SMILES Oc1ccc2c(noc2c1)-c1cc(Cl)c(O)cc1O
Show InChI InChI=1S/C13H8ClNO4/c14-9-4-8(10(17)5-11(9)18)13-7-2-1-6(16)3-12(7)19-15-13/h1-5,16-18H
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n/an/a 2n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154140
PNG
(2-(2-Fluoro-4-hydroxy-phenyl)-7-vinyl-benzooxazol-...)
Show SMILES Oc1ccc(-c2nc3cc(O)cc(C=C)c3o2)c(F)c1
Show InChI InChI=1S/C15H10FNO3/c1-2-8-5-10(19)7-13-14(8)20-15(17-13)11-4-3-9(18)6-12(11)16/h2-7,18-19H,1H2
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n/an/a 2.20n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154064
PNG
(2-(2-Fluoro-4-hydroxy-phenyl)-5-hydroxy-benzooxazo...)
Show SMILES Oc1ccc(-c2nc3cc(O)cc(C#N)c3o2)c(F)c1
Show InChI InChI=1S/C14H7FN2O3/c15-11-4-8(18)1-2-10(11)14-17-12-5-9(19)3-7(6-16)13(12)20-14/h1-5,18-19H
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n/an/a 2.40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154084
PNG
(7-Bromo-2-(3-fluoro-4-hydroxy-phenyl)-benzooxazol-...)
Show SMILES Oc1cc(Br)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C13H7BrFNO3/c14-8-4-7(17)5-10-12(8)19-13(16-10)6-1-2-11(18)9(15)3-6/h1-5,17-18H
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n/an/a 3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154066
PNG
(4-(6-Hydroxy-benzooxazol-2-yl)-benzene-1,3-diol | ...)
Show SMILES Oc1ccc(-c2nc3ccc(O)cc3o2)c(O)c1
Show InChI InChI=1S/C13H9NO4/c15-7-1-3-9(11(17)5-7)13-14-10-4-2-8(16)6-12(10)18-13/h1-6,15-17H
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n/an/a 3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154073
PNG
(7-Allyl-2-(2-fluoro-4-hydroxy-phenyl)-benzooxazol-...)
Show SMILES Oc1ccc(-c2nc3cc(O)cc(CC=C)c3o2)c(F)c1
Show InChI InChI=1S/C16H12FNO3/c1-2-3-9-6-11(20)8-14-15(9)21-16(18-14)12-5-4-10(19)7-13(12)17/h2,4-8,19-20H,1,3H2
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n/an/a 3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154135
PNG
(2-(6-Hydroxy-naphthalen-1-yl)-benzooxazol-6-ol | 2...)
Show SMILES Oc1ccc2nc(oc2c1)-c1cccc2cc(O)ccc12
Show InChI InChI=1S/C17H11NO3/c19-11-4-6-13-10(8-11)2-1-3-14(13)17-18-15-7-5-12(20)9-16(15)21-17/h1-9,19-20H
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n/an/a 3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154111
PNG
(3-(4-Hydroxy-2,5-dipropyl-phenyl)-benzo[d]isoxazol...)
Show SMILES CCCc1cc(-c2noc3cc(O)ccc23)c(CCC)cc1O
Show InChI InChI=1S/C19H21NO3/c1-3-5-12-10-17(22)13(6-4-2)9-16(12)19-15-8-7-14(21)11-18(15)23-20-19/h7-11,21-22H,3-6H2,1-2H3
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n/an/a 3.10n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242648
PNG
(2-(3-fluoro-4-hydroxyphenyl)-7-(2-fluorovinyl)benz...)
Show SMILES Oc1cc(\C=C\F)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C15H9F2NO3/c16-4-3-8-5-10(19)7-12-14(8)21-15(18-12)9-1-2-13(20)11(17)6-9/h1-7,19-20H/b4-3+
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n/an/a 3.20n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154044
PNG
(2-(4-Hydroxy-phenyl)-7-vinyl-benzooxazol-5-ol | 2-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(C=C)c2o1
Show InChI InChI=1S/C15H11NO3/c1-2-9-7-12(18)8-13-14(9)19-15(16-13)10-3-5-11(17)6-4-10/h2-8,17-18H,1H2
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n/an/a 3.5n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154119
PNG
(3-(2-Ethyl-4-hydroxy-5-propyl-phenyl)-benzo[d]isox...)
Show SMILES CCCc1cc(-c2noc3cc(O)ccc23)c(CC)cc1O
Show InChI InChI=1S/C18H19NO3/c1-3-5-12-8-15(11(4-2)9-16(12)21)18-14-7-6-13(20)10-17(14)22-19-18/h6-10,20-21H,3-5H2,1-2H3
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n/an/a 3.60n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154047
PNG
(2-(2,3-Difluoro-4-hydroxy-phenyl)-7-vinyl-benzooxa...)
Show SMILES Oc1cc(C=C)c2oc(nc2c1)-c1ccc(O)c(F)c1F
Show InChI InChI=1S/C15H9F2NO3/c1-2-7-5-8(19)6-10-14(7)21-15(18-10)9-3-4-11(20)13(17)12(9)16/h2-6,19-20H,1H2
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n/an/a 3.70n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154055
PNG
(2-(3-FLUORO-4-HYDROXYPHENYL)-7-VINYL-1,3-BENZOXAZO...)
Show SMILES Oc1cc(C=C)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C15H10FNO3/c1-2-8-5-10(18)7-12-14(8)20-15(17-12)9-3-4-13(19)11(16)6-9/h2-7,18-19H,1H2
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n/an/a 5n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154062
PNG
(2-(5-HYDROXY-NAPHTHALEN-1-YL)-1,3-BENZOOXAZOL-6-OL...)
Show SMILES Oc1ccc2nc(oc2c1)-c1cccc2c(O)cccc12
Show InChI InChI=1S/C17H11NO3/c19-10-7-8-14-16(9-10)21-17(18-14)13-5-1-4-12-11(13)3-2-6-15(12)20/h1-9,19-20H
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n/an/a 5n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154063
PNG
(4-(6-Hydroxy-benzo[d]isoxazol-3-yl)-6-methyl-benze...)
Show SMILES Cc1cc(-c2noc3cc(O)ccc23)c(O)cc1O
Show InChI InChI=1S/C14H11NO4/c1-7-4-10(12(18)6-11(7)17)14-9-3-2-8(16)5-13(9)19-15-14/h2-6,16-18H,1H3
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n/an/a 5n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154067
PNG
(2-(5-Hydroxy-7-methyl-naphthalen-1-yl)-benzooxazol...)
Show SMILES Cc1cc(O)c2cccc(-c3nc4ccc(O)cc4o3)c2c1
Show InChI InChI=1S/C18H13NO3/c1-10-7-14-12(16(21)8-10)3-2-4-13(14)18-19-15-6-5-11(20)9-17(15)22-18/h2-9,20-21H,1H3
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n/an/a 6n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154045
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(C#N)c2o1
Show InChI InChI=1S/C14H8N2O3/c15-7-9-5-11(18)6-12-13(9)19-14(16-12)8-1-3-10(17)4-2-8/h1-6,17-18H
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n/an/a 6n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154057
PNG
(2-(4-Hydroxy-phenyl)-benzooxazol-5-ol | 2-(4-hydro...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)ccc2o1
Show InChI InChI=1S/C13H9NO3/c15-9-3-1-8(2-4-9)13-14-11-7-10(16)5-6-12(11)17-13/h1-7,15-16H
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n/an/a 6n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154057
PNG
(2-(4-Hydroxy-phenyl)-benzooxazol-5-ol | 2-(4-hydro...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)ccc2o1
Show InChI InChI=1S/C13H9NO3/c15-9-3-1-8(2-4-9)13-14-11-7-10(16)5-6-12(11)17-13/h1-7,15-16H
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n/an/a 6n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154108
PNG
(3-(3-Fluoro-4-hydroxy-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C13H8FNO3/c14-10-5-7(1-4-11(10)17)13-9-3-2-8(16)6-12(9)18-15-13/h1-6,16-17H
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n/an/a 8n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154106
PNG
(3-(3-Chloro-4-hydroxy-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc(O)c(Cl)c1
Show InChI InChI=1S/C13H8ClNO3/c14-10-5-7(1-4-11(10)17)13-9-3-2-8(16)6-12(9)18-15-13/h1-6,16-17H
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n/an/a 10n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154118
PNG
(2-(4-Hydroxy-phenyl)-7-propyl-benzooxazol-5-ol | 2...)
Show SMILES CCCc1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C16H15NO3/c1-2-3-11-8-13(19)9-14-15(11)20-16(17-14)10-4-6-12(18)7-5-10/h4-9,18-19H,2-3H2,1H3
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n/an/a 11n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154092
PNG
(3-(3-Bromo-4-hydroxy-phenyl)-benzo[d]isoxazol-6-ol...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc(O)c(Br)c1
Show InChI InChI=1S/C13H8BrNO3/c14-10-5-7(1-4-11(10)17)13-9-3-2-8(16)6-12(9)18-15-13/h1-6,16-17H
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n/an/a 12n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154051
PNG
(5-Hydroxy-2-(6-hydroxy-benzo[d]isoxazol-3-yl)-benz...)
Show SMILES Oc1ccc(-c2noc3cc(O)ccc23)c(c1)C#N
Show InChI InChI=1S/C14H8N2O3/c15-7-8-5-9(17)1-3-11(8)14-12-4-2-10(18)6-13(12)19-16-14/h1-6,17-18H
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n/an/a 12n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154043
PNG
(7-Ethyl-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 7-...)
Show SMILES CCc1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C15H13NO3/c1-2-9-7-12(18)8-13-14(9)19-15(16-13)10-3-5-11(17)6-4-10/h3-8,17-18H,2H2,1H3
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n/an/a 13n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154139
PNG
(7-Allyl-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 7-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(CC=C)c2o1
Show InChI InChI=1S/C16H13NO3/c1-2-3-11-8-13(19)9-14-15(11)20-16(17-14)10-4-6-12(18)7-5-10/h2,4-9,18-19H,1,3H2
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n/an/a 13n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154076
PNG
(7-Allyl-2-(3-fluoro-4-hydroxy-phenyl)-benzooxazol-...)
Show SMILES Oc1cc(CC=C)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C16H12FNO3/c1-2-3-9-6-11(19)8-13-15(9)21-16(18-13)10-4-5-14(20)12(17)7-10/h2,4-8,19-20H,1,3H2
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n/an/a 14n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154112
PNG
(7-Ethynyl-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | ...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(C#C)c2o1
Show InChI InChI=1S/C15H9NO3/c1-2-9-7-12(18)8-13-14(9)19-15(16-13)10-3-5-11(17)6-4-10/h1,3-8,17-18H
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n/an/a 15n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154056
PNG
(2-(6-Hydroxy-naphthalen-1-yl)-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc2oc(nc2c1)-c1cccc2cc(O)ccc12
Show InChI InChI=1S/C17H11NO3/c19-11-4-6-13-10(8-11)2-1-3-14(13)17-18-15-9-12(20)5-7-16(15)21-17/h1-9,19-20H
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n/an/a 15n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242651
PNG
(7-(2-bromovinyl)-2-(2-fluoro-4-hydroxyphenyl)benzo...)
Show SMILES Oc1ccc(-c2nc3cc(O)cc(\C=C\Br)c3o2)c(F)c1
Show InChI InChI=1S/C15H9BrFNO3/c16-4-3-8-5-10(20)7-13-14(8)21-15(18-13)11-2-1-9(19)6-12(11)17/h1-7,19-20H/b4-3+
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n/an/a 16n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154113
PNG
(6-Chloro-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 6...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)c(Cl)cc2o1
Show InChI InChI=1S/C13H8ClNO3/c14-9-5-12-10(6-11(9)17)15-13(18-12)7-1-3-8(16)4-2-7/h1-6,16-17H
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n/an/a 16n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154087
PNG
(3-(6-Hydroxy-naphthalen-1-yl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1cccc2cc(O)ccc12
Show InChI InChI=1S/C17H11NO3/c19-11-4-6-13-10(8-11)2-1-3-14(13)17-15-7-5-12(20)9-16(15)21-18-17/h1-9,19-20H
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n/an/a 17n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154121
PNG
(3-(5-Hydroxy-naphthalen-2-yl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc2c(O)cccc2c1
Show InChI InChI=1S/C17H11NO3/c19-12-5-7-14-16(9-12)21-18-17(14)11-4-6-13-10(8-11)2-1-3-15(13)20/h1-9,19-20H
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n/an/a 20n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154100
PNG
(3-(4-Hydroxy-2-propyl-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES CCCc1cc(O)ccc1-c1noc2cc(O)ccc12
Show InChI InChI=1S/C16H15NO3/c1-2-3-10-8-11(18)4-6-13(10)16-14-7-5-12(19)9-15(14)20-17-16/h4-9,18-19H,2-3H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154085
PNG
(4-Bromo-2-(3-fluoro-4-hydroxy-phenyl)-7-vinyl-benz...)
Show SMILES Oc1ccc(cc1F)-c1nc2c(Br)c(O)cc(C=C)c2o1
Show InChI InChI=1S/C15H9BrFNO3/c1-2-7-6-11(20)12(16)13-14(7)21-15(18-13)8-3-4-10(19)9(17)5-8/h2-6,19-20H,1H2
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n/an/a 25n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154109
PNG
(4-(5-Hydroxy-benzooxazol-2-yl)-benzene-1,3-diol | ...)
Show SMILES Oc1ccc(-c2nc3cc(O)ccc3o2)c(O)c1
Show InChI InChI=1S/C13H9NO4/c15-7-2-4-12-10(5-7)14-13(18-12)9-3-1-8(16)6-11(9)17/h1-6,15-17H
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n/an/a 25n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154089
PNG
(3-(4-Hydroxy-3-propyl-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES CCCc1cc(ccc1O)-c1noc2cc(O)ccc12
Show InChI InChI=1S/C16H15NO3/c1-2-3-10-8-11(4-7-14(10)19)16-13-6-5-12(18)9-15(13)20-17-16/h4-9,18-19H,2-3H2,1H3
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n/an/a 25n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154141
PNG
(2-(3-Fluoro-4-hydroxy-phenyl)-5-hydroxy-benzooxazo...)
Show SMILES Oc1cc(C#N)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C14H7FN2O3/c15-10-4-7(1-2-12(10)19)14-17-11-5-9(18)3-8(6-16)13(11)20-14/h1-5,18-19H
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n/an/a 26n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154074
PNG
(2-(4-Hydroxy-2-methyl-phenyl)-7-vinyl-benzooxazol-...)
Show SMILES Cc1cc(O)ccc1-c1nc2cc(O)cc(C=C)c2o1
Show InChI InChI=1S/C16H13NO3/c1-3-10-7-12(19)8-14-15(10)20-16(17-14)13-5-4-11(18)6-9(13)2/h3-8,18-19H,1H2,2H3
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n/an/a 27n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154086
PNG
(3-(4-Hydroxy-3-methyl-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES Cc1cc(ccc1O)-c1noc2cc(O)ccc12
Show InChI InChI=1S/C14H11NO3/c1-8-6-9(2-5-12(8)17)14-11-4-3-10(16)7-13(11)18-15-14/h2-7,16-17H,1H3
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n/an/a 31n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154138
PNG
(4-(6-Hydroxy-benzo[d]isoxazol-3-yl)-2-methyl-benze...)
Show SMILES Cc1c(O)ccc(-c2noc3cc(O)ccc23)c1O
Show InChI InChI=1S/C14H11NO4/c1-7-11(17)5-4-10(14(7)18)13-9-3-2-8(16)6-12(9)19-15-13/h2-6,16-18H,1H3
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n/an/a 33n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154081
PNG
(3-(4-Hydroxy-2-methyl-phenyl)-benzo[d]isoxazol-6-o...)
Show SMILES Cc1cc(O)ccc1-c1noc2cc(O)ccc12
Show InChI InChI=1S/C14H11NO3/c1-8-6-9(16)2-4-11(8)14-12-5-3-10(17)7-13(12)18-15-14/h2-7,16-17H,1H3
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n/an/a 37n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154080
PNG
(2-(3-Fluoro-4-hydroxy-phenyl)-benzooxazol-6-ol | 2...)
Show SMILES Oc1ccc2nc(oc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C13H8FNO3/c14-9-5-7(1-4-11(9)17)13-15-10-3-2-8(16)6-12(10)18-13/h1-6,16-17H
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n/an/a 39n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154142
PNG
(7-(bromomethyl)-2-(4-hydroxyphenyl)benzo[d]oxazol-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(CBr)c2o1
Show InChI InChI=1S/C14H10BrNO3/c15-7-9-5-11(18)6-12-13(9)19-14(16-12)8-1-3-10(17)4-2-8/h1-6,17-18H,7H2
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n/an/a 40n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154068
PNG
(6-Bromo-2-(3-fluoro-4-hydroxy-phenyl)-benzooxazol-...)
Show SMILES Oc1ccc(cc1F)-c1nc2cc(O)c(Br)cc2o1
Show InChI InChI=1S/C13H7BrFNO3/c14-7-4-12-9(5-11(7)18)16-13(19-12)6-1-2-10(17)8(15)3-6/h1-5,17-18H
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n/an/a 42n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242650
PNG
(7-(2-bromovinyl)-2-(4-hydroxyphenyl)benzo[d]oxazol...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(\C=C\Br)c2o1
Show InChI InChI=1S/C15H10BrNO3/c16-6-5-10-7-12(19)8-13-14(10)20-15(17-13)9-1-3-11(18)4-2-9/h1-8,18-19H/b6-5+
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n/an/a 45n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154117
PNG
(3-(4-Hydroxy-phenyl)-benzo[d]isoxazol-5-ol | 3-(4-...)
Show SMILES Oc1ccc(cc1)-c1noc2ccc(O)cc12
Show InChI InChI=1S/C13H9NO3/c15-9-3-1-8(2-4-9)13-11-7-10(16)5-6-12(11)17-14-13/h1-7,15-16H
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n/an/a 46n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154058
PNG
(5-Fluoro-2-(6-hydroxy-naphthalen-1-yl)-benzooxazol...)
Show SMILES Oc1ccc2c(cccc2c1)-c1nc2cc(F)c(O)cc2o1
Show InChI InChI=1S/C17H10FNO3/c18-13-7-14-16(8-15(13)21)22-17(19-14)12-3-1-2-9-6-10(20)4-5-11(9)12/h1-8,20-21H
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n/an/a 46n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154053
PNG
(2-(4-Hydroxy-phenyl)-benzooxazol-6-ol | 2-(4-hydro...)
Show SMILES Oc1ccc(cc1)-c1nc2ccc(O)cc2o1
Show InChI InChI=1S/C13H9NO3/c15-9-3-1-8(2-4-9)13-14-11-6-5-10(16)7-12(11)17-13/h1-7,15-16H
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n/an/a 50n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154129
PNG
(4-Bromo-2-(3-fluoro-4-hydroxy-phenyl)-7-methoxy-be...)
Show SMILES COc1cc(O)c(Br)c2nc(oc12)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C14H9BrFNO4/c1-20-10-5-9(19)11(15)12-13(10)21-14(17-12)6-2-3-8(18)7(16)4-6/h2-5,18-19H,1H3
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n/an/a 52n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154050
PNG
(3-(4-Hydroxy-phenyl)-benzo[d]isoxazol-6-ol | 3-(4-...)
Show SMILES Oc1ccc(cc1)-c1noc2cc(O)ccc12
Show InChI InChI=1S/C13H9NO3/c15-9-3-1-8(2-4-9)13-11-6-5-10(16)7-12(11)17-14-13/h1-7,15-16H
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n/an/a 54n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154110
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(C=O)c2o1
Show InChI InChI=1S/C14H9NO4/c16-7-9-5-11(18)6-12-13(9)19-14(15-12)8-1-3-10(17)4-2-8/h1-7,17-18H
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n/an/a 59n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154133
PNG
(2-(4-Hydroxy-phenyl)-7-methoxy-benzooxazol-5-ol | ...)
Show SMILES COc1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C14H11NO4/c1-18-12-7-10(17)6-11-13(12)19-14(15-11)8-2-4-9(16)5-3-8/h2-7,16-17H,1H3
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n/an/a 59n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154127
PNG
(2-(2-Chloro-4-hydroxy-phenyl)-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc(-c2nc3cc(O)ccc3o2)c(Cl)c1
Show InChI InChI=1S/C13H8ClNO3/c14-10-5-7(16)1-3-9(10)13-15-11-6-8(17)2-4-12(11)18-13/h1-6,16-17H
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n/an/a 59n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154126
PNG
(6-Chloro-2-(3-fluoro-4-hydroxy-phenyl)-benzooxazol...)
Show SMILES Oc1ccc(cc1F)-c1nc2cc(O)c(Cl)cc2o1
Show InChI InChI=1S/C13H7ClFNO3/c14-7-4-12-9(5-11(7)18)16-13(19-12)6-1-2-10(17)8(15)3-6/h1-5,17-18H
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n/an/a 64n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154046
PNG
(4,6-Dibromo-2-(3-fluoro-4-hydroxy-phenyl)-7-methox...)
Show SMILES COc1c(Br)c(O)c(Br)c2nc(oc12)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C14H8Br2FNO4/c1-21-12-9(16)11(20)8(15)10-13(12)22-14(18-10)5-2-3-7(19)6(17)4-5/h2-4,19-20H,1H3
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n/an/a 64n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154070
PNG
(2-(2,5-Difluoro-4-hydroxy-phenyl)-7-vinyl-benzooxa...)
Show SMILES Oc1cc(C=C)c2oc(nc2c1)-c1cc(F)c(O)cc1F
Show InChI InChI=1S/C15H9F2NO3/c1-2-7-3-8(19)4-12-14(7)21-15(18-12)9-5-11(17)13(20)6-10(9)16/h2-6,19-20H,1H2
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n/an/a 66n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154143
PNG
(2-(3-Fluoro-4-hydroxy-phenyl)-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C13H8FNO3/c14-9-5-7(1-3-11(9)17)13-15-10-6-8(16)2-4-12(10)18-13/h1-6,16-17H
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n/an/a 66n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154124
PNG
(7-Butyl-2-(4-hydroxy-phenyl)-benzooxazol-5-ol | 7-...)
Show SMILES CCCCc1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C17H17NO3/c1-2-3-4-12-9-14(20)10-15-16(12)21-17(18-15)11-5-7-13(19)8-6-11/h5-10,19-20H,2-4H2,1H3
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n/an/a 79n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154090
PNG
(2-(4-Hydroxy-phenyl)-7-isopropyl-benzooxazol-5-ol ...)
Show SMILES CC(C)c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C16H15NO3/c1-9(2)13-7-12(19)8-14-15(13)20-16(17-14)10-3-5-11(18)6-4-10/h3-9,18-19H,1-2H3
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n/an/a 82n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154116
PNG
(3-(5-Bromo-6-hydroxy-naphthalen-2-yl)-benzo[d]isox...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccc2c(Br)c(O)ccc2c1
Show InChI InChI=1S/C17H10BrNO3/c18-16-12-4-1-10(7-9(12)2-6-14(16)21)17-13-5-3-11(20)8-15(13)22-19-17/h1-8,20-21H
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n/an/a 87n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154128
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES NC(=O)c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C14H10N2O4/c15-13(19)10-5-9(18)6-11-12(10)20-14(16-11)7-1-3-8(17)4-2-7/h1-6,17-18H,(H2,15,19)
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n/an/a 95n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154075
PNG
(2-(5-hydroxy-2-(6-hydroxybenzo[d]isoxazol-3-yl)phe...)
Show SMILES Oc1ccc(-c2noc3cc(O)ccc23)c(CC#N)c1
Show InChI InChI=1S/C15H10N2O3/c16-6-5-9-7-10(18)1-3-12(9)15-13-4-2-11(19)8-14(13)20-17-15/h1-4,7-8,18-19H,5H2
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n/an/a 96n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154082
PNG
(2-(4-Hydroxy-phenyl)-7-thiophen-2-yl-benzooxazol-5...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(-c3cccs3)c2o1
Show InChI InChI=1S/C17H11NO3S/c19-11-5-3-10(4-6-11)17-18-14-9-12(20)8-13(16(14)21-17)15-2-1-7-22-15/h1-9,19-20H
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n/an/a 97n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154054
PNG
(7-Cyclopentyl-2-(4-hydroxy-phenyl)-benzooxazol-5-o...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(C3CCCC3)c2o1
Show InChI InChI=1S/C18H17NO3/c20-13-7-5-12(6-8-13)18-19-16-10-14(21)9-15(17(16)22-18)11-3-1-2-4-11/h5-11,20-21H,1-4H2
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n/an/a 102n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154079
PNG
(4-(6-Hydroxy-benzooxazol-2-yl)-benzene-1,2-diol | ...)
Show SMILES Oc1ccc2nc(oc2c1)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C13H9NO4/c15-8-2-3-9-12(6-8)18-13(14-9)7-1-4-10(16)11(17)5-7/h1-6,15-17H
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n/an/a 105n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154049
PNG
(3-(6-Hydroxy-naphthalen-2-yl)-benzo[d]isoxazol-5-o...)
Show SMILES Oc1ccc2onc(-c3ccc4cc(O)ccc4c3)c2c1
Show InChI InChI=1S/C17H11NO3/c19-13-4-3-10-7-12(2-1-11(10)8-13)17-15-9-14(20)5-6-16(15)21-18-17/h1-9,19-20H
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n/an/a 112n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154105
PNG
(2-(5-Bromo-6-hydroxy-naphthalen-1-yl)-benzooxazol-...)
Show SMILES Oc1ccc2nc(oc2c1)-c1cccc2c(Br)c(O)ccc12
Show InChI InChI=1S/C17H10BrNO3/c18-16-11-2-1-3-12(10(11)5-7-14(16)21)17-19-13-6-4-9(20)8-15(13)22-17/h1-8,20-21H
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n/an/a 134n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154104
PNG
(7-(furan-2-yl)-2-(4-hydroxyphenyl)benzo[d]oxazol-5...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(-c3ccco3)c2o1
Show InChI InChI=1S/C17H11NO4/c19-11-5-3-10(4-6-11)17-18-14-9-12(20)8-13(16(14)22-17)15-2-1-7-21-15/h1-9,19-20H
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n/an/a 135n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154130
PNG
(4-(5-Hydroxy-benzo[d]isoxazol-3-yl)-benzene-1,3-di...)
Show SMILES Oc1ccc(-c2noc3ccc(O)cc23)c(O)c1
Show InChI InChI=1S/C13H9NO4/c15-7-2-4-12-10(5-7)13(14-18-12)9-3-1-8(16)6-11(9)17/h1-6,15-17H
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n/an/a 138n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242649
PNG
(2-(4-hydroxyphenyl)-7-(prop-1-enyl)benzo[d]oxazol-...)
Show SMILES C\C=C\c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C16H13NO3/c1-2-3-11-8-13(19)9-14-15(11)20-16(17-14)10-4-6-12(18)7-5-10/h2-9,18-19H,1H3/b3-2+
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n/an/a 142n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154065
PNG
(4,6-Dibromo-2-(3-fluoro-4-hydroxy-phenyl)-7-vinyl-...)
Show SMILES Oc1ccc(cc1F)-c1nc2c(Br)c(O)c(Br)c(C=C)c2o1
Show InChI InChI=1S/C15H8Br2FNO3/c1-2-7-10(16)13(21)11(17)12-14(7)22-15(19-12)6-3-4-9(20)8(18)5-6/h2-5,20-21H,1H2
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n/an/a 155n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154131
PNG
(5-Chloro-2-(4-hydroxy-phenyl)-benzooxazol-6-ol | 5...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(Cl)c(O)cc2o1
Show InChI InChI=1S/C13H8ClNO3/c14-9-5-10-12(6-11(9)17)18-13(15-10)7-1-3-8(16)4-2-7/h1-6,16-17H
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n/an/a 157n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242646
PNG
(7-bromo-2-(2-fluoro-4-hydroxy-3-(trifluoromethyl)p...)
Show SMILES Oc1cc(Br)c2oc(nc2c1)-c1ccc(O)c(c1F)C(F)(F)F
Show InChI InChI=1S/C14H6BrF4NO3/c15-7-3-5(21)4-8-12(7)23-13(20-8)6-1-2-9(22)10(11(6)16)14(17,18)19/h1-4,21-22H
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n/an/a 166n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154103
PNG
(3-(6-Hydroxy-benzooxazol-2-yl)-benzene-1,2-diol | ...)
Show SMILES Oc1ccc2nc(oc2c1)-c1cccc(O)c1O
Show InChI InChI=1S/C13H9NO4/c15-7-4-5-9-11(6-7)18-13(14-9)8-2-1-3-10(16)12(8)17/h1-6,15-17H
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n/an/a 181n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154093
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES CCOC(=O)c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C16H13NO5/c1-2-21-16(20)12-7-11(19)8-13-14(12)22-15(17-13)9-3-5-10(18)6-4-9/h3-8,18-19H,2H2,1H3
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n/an/a 190n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154069
PNG
(2-(3,5-Difluoro-4-hydroxy-phenyl)-7-vinyl-benzooxa...)
Show SMILES Oc1cc(C=C)c2oc(nc2c1)-c1cc(F)c(O)c(F)c1
Show InChI InChI=1S/C15H9F2NO3/c1-2-7-3-9(19)6-12-14(7)21-15(18-12)8-4-10(16)13(20)11(17)5-8/h2-6,19-20H,1H2
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n/an/a 201n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154125
PNG
(2-(4-Hydroxy-phenyl)-7-phenyl-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(-c3ccccc3)c2o1
Show InChI InChI=1S/C19H13NO3/c21-14-8-6-13(7-9-14)19-20-17-11-15(22)10-16(18(17)23-19)12-4-2-1-3-5-12/h1-11,21-22H
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n/an/a 235n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154136
PNG
(2-(3-Chloro-4-hydroxy-phenyl)-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc2oc(nc2c1)-c1ccc(O)c(Cl)c1
Show InChI InChI=1S/C13H8ClNO3/c14-9-5-7(1-3-11(9)17)13-15-10-6-8(16)2-4-12(10)18-13/h1-6,16-17H
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n/an/a 239n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154107
PNG
(3-(2-Hydroxy-phenyl)-benzo[d]isoxazol-6-ol | 3-(2-...)
Show SMILES Oc1ccc2c(noc2c1)-c1ccccc1O
Show InChI InChI=1S/C13H9NO3/c15-8-5-6-10-12(7-8)17-14-13(10)9-3-1-2-4-11(9)16/h1-7,15-16H
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n/an/a 254n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50242656
PNG
(2-(3-fluoro-4-hydroxyphenyl)-7-(furan-3-yl)benzo[d...)
Show SMILES Oc1cc(-c2ccoc2)c2oc(nc2c1)-c1ccc(O)c(F)c1
Show InChI InChI=1S/C17H10FNO4/c18-13-5-9(1-2-15(13)21)17-19-14-7-11(20)6-12(16(14)23-17)10-3-4-22-8-10/h1-8,20-21H
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n/an/a 313n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154052
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES COC(=O)c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C15H11NO5/c1-20-15(19)11-6-10(18)7-12-13(11)21-14(16-12)8-2-4-9(17)5-3-8/h2-7,17-18H,1H3
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n/an/a 356n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154071
PNG
(2-(4-Hydroxy-phenyl)-7-thiazol-2-yl-benzooxazol-5-...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(-c3nccs3)c2o1
Show InChI InChI=1S/C16H10N2O3S/c19-10-3-1-9(2-4-10)15-18-13-8-11(20)7-12(14(13)21-15)16-17-5-6-22-16/h1-8,19-20H
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n/an/a 366n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154099
PNG
(5-Hydroxy-2-(6-hydroxy-benzo[d]isoxazol-3-yl)-benz...)
Show SMILES Oc1ccc(-c2noc3cc(O)ccc23)c(CN=O)c1
Show InChI InChI=1S/C14H10N2O4/c17-9-1-3-11(8(5-9)7-15-19)14-12-4-2-10(18)6-13(12)20-16-14/h1-6,17-18H,7H2
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n/an/a 383n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154095
PNG
(2-(6-Hydroxy-naphthalen-2-yl)-benzooxazol-5-ol | 2...)
Show SMILES Oc1ccc2oc(nc2c1)-c1ccc2cc(O)ccc2c1
Show InChI InChI=1S/C17H11NO3/c19-13-4-3-10-7-12(2-1-11(10)8-13)17-18-15-9-14(20)5-6-16(15)21-17/h1-9,19-20H
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n/an/a 521n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154102
PNG
(2-(6-Hydroxy-naphthalen-2-yl)-benzooxazol-6-ol | 2...)
Show SMILES Oc1ccc2nc(oc2c1)-c1ccc2cc(O)ccc2c1
Show InChI InChI=1S/C17H11NO3/c19-13-4-3-10-7-12(2-1-11(10)8-13)17-18-15-6-5-14(20)9-16(15)21-17/h1-9,19-20H
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n/an/a 533n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154098
PNG
(2-(3-Chloro-4-hydroxy-phenyl)-benzooxazol-6-ol | 2...)
Show SMILES Oc1ccc2nc(oc2c1)-c1ccc(O)c(Cl)c1
Show InChI InChI=1S/C13H8ClNO3/c14-9-5-7(1-4-11(9)17)13-15-10-3-2-8(16)6-12(10)18-13/h1-6,16-17H
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n/an/a 703n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154097
PNG
(4-(benzo[d]isoxazol-3-yl)benzene-1,3-diol | 4-Benz...)
Show SMILES Oc1ccc(-c2noc3ccccc23)c(O)c1
Show InChI InChI=1S/C13H9NO3/c15-8-5-6-9(11(16)7-8)13-10-3-1-2-4-12(10)17-14-13/h1-7,15-16H
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n/an/a 718n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154083
PNG
(3-(7-Hydroxy-naphthalen-1-yl)-benzo[d]isoxazol-6-o...)
Show SMILES Oc1ccc2c(noc2c1)-c1cccc2ccc(O)cc12
Show InChI InChI=1S/C17H11NO3/c19-11-5-4-10-2-1-3-13(15(10)8-11)17-14-7-6-12(20)9-16(14)21-18-17/h1-9,19-20H
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n/an/a 879n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154122
PNG
(3-(5-Hydroxy-benzooxazol-2-yl)-benzene-1,2-diol | ...)
Show SMILES Oc1ccc2oc(nc2c1)-c1cccc(O)c1O
Show InChI InChI=1S/C13H9NO4/c15-7-4-5-11-9(6-7)14-13(18-11)8-2-1-3-10(16)12(8)17/h1-6,15-17H
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n/an/a 963n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154101
PNG
(2-(5-hydroxy-2-(4-hydroxyphenyl)benzo[d]oxazol-7-y...)
Show SMILES Oc1ccc(cc1)-c1nc2cc(O)cc(CC#N)c2o1
Show InChI InChI=1S/C15H10N2O3/c16-6-5-10-7-12(19)8-13-14(10)20-15(17-13)9-1-3-11(18)4-2-9/h1-4,7-8,18-19H,5H2
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n/an/a 1.04E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154077
PNG
(2-(naphthalen-1-yl)benzo[d]oxazol-6-ol | 2-Naphtha...)
Show SMILES Oc1ccc2nc(oc2c1)-c1cccc2ccccc12
Show InChI InChI=1S/C17H11NO2/c19-12-8-9-15-16(10-12)20-17(18-15)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,19H
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n/an/a 1.05E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154144
PNG
(7-(hydroxymethyl)-2-(4-hydroxyphenyl)benzo[d]oxazo...)
Show SMILES OCc1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C14H11NO4/c16-7-9-5-11(18)6-12-13(9)19-14(15-12)8-1-3-10(17)4-2-8/h1-6,16-18H,7H2
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n/an/a 1.34E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154114
PNG
(2-(4-Hydroxy-naphthalen-1-yl)-benzooxazol-6-ol | 2...)
Show SMILES Oc1ccc2nc(oc2c1)-c1ccc(O)c2ccccc12
Show InChI InChI=1S/C17H11NO3/c19-10-5-7-14-16(9-10)21-17(18-14)13-6-8-15(20)12-4-2-1-3-11(12)13/h1-9,19-20H
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n/an/a 1.53E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154094
PNG
(2-(3-tert-Butyl-4-hydroxy-phenyl)-benzooxazol-6-ol...)
Show SMILES CC(C)(C)c1cc(ccc1O)-c1nc2ccc(O)cc2o1
Show InChI InChI=1S/C17H17NO3/c1-17(2,3)12-8-10(4-7-14(12)20)16-18-13-6-5-11(19)9-15(13)21-16/h4-9,19-20H,1-3H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154120
PNG
(2-(3-Butoxy-4-hydroxy-phenyl)-benzooxazol-6-ol | 2...)
Show SMILES CCCCOc1cc(ccc1O)-c1nc2ccc(O)cc2o1
Show InChI InChI=1S/C17H17NO4/c1-2-3-8-21-16-9-11(4-7-14(16)20)17-18-13-6-5-12(19)10-15(13)22-17/h4-7,9-10,19-20H,2-3,8H2,1H3
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n/an/a 3.66E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))		BDBM50154123
PNG
(5-Hydroxy-2-(4-hydroxy-phenyl)-benzooxazole-7-carb...)
Show SMILES OC(=O)c1cc(O)cc2nc(oc12)-c1ccc(O)cc1
Show InChI InChI=1S/C14H9NO5/c16-8-3-1-7(2-4-8)13-15-11-6-9(17)5-10(14(18)19)12(11)20-13/h1-6,16-17H,(H,18,19)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Yantai University

Curated by ChEMBL


Assay Description
Binding affinity to ERbeta (unknown origin)

Eur J Med Chem 43: 43-52 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.002
BindingDB Entry DOI: 10.7270/Q2WD40BT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%