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Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'greene' and Initial = 'gl'   
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


(Homo sapiens (Human))
BDBM19455
PNG
(4-(3-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-5,7-bis(...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(OCCN2CCCCC2)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H24F6N4O2/c28-26(29,30)21-16-22(27(31,32)33)37-25(34-21)23(24(35-37)18-4-8-19(38)9-5-18)17-6-10-20(11-7-17)39-15-14-36-12-2-1-3-13-36/h4-11,16,38H,1-3,12-15H2
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PubMed
7 -42.6n/an/a 90n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19454
PNG
(4-[2-(4-hydroxyphenyl)-5,7-bis(trifluoromethyl)pyr...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(O)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O2/c21-19(22,23)14-9-15(20(24,25)26)29-18(27-14)16(10-1-5-12(30)6-2-10)17(28-29)11-3-7-13(31)8-4-11/h1-9,30-31H
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PubMed
26 -39.7n/an/a 6.00E+3n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19456
PNG
(4-(3-{4-[2-(dimethylamino)ethoxy]phenyl}-5,7-bis(t...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccc(O)cc1
Show InChI InChI=1S/C24H20F6N4O2/c1-33(2)11-12-36-17-9-5-14(6-10-17)20-21(15-3-7-16(35)8-4-15)32-34-19(24(28,29)30)13-18(23(25,26)27)31-22(20)34/h3-10,13,35H,11-12H2,1-2H3
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PubMed
47 -38.3n/an/a 1.00E+3n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19454
PNG
(4-[2-(4-hydroxyphenyl)-5,7-bis(trifluoromethyl)pyr...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(O)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O2/c21-19(22,23)14-9-15(20(24,25)26)29-18(27-14)16(10-1-5-12(30)6-2-10)17(28-29)11-3-7-13(31)8-4-11/h1-9,30-31H
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PubMed
48 -38.3n/an/a 600n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19453
PNG
(4-[3-phenyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccccc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-4-2-1-3-5-11)17(28-29)12-6-8-13(30)9-7-12/h1-10,30H
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PubMed
51 -38.1n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19455
PNG
(4-(3-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-5,7-bis(...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(OCCN2CCCCC2)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H24F6N4O2/c28-26(29,30)21-16-22(27(31,32)33)37-25(34-21)23(24(35-37)18-4-8-19(38)9-5-18)17-6-10-20(11-7-17)39-15-14-36-12-2-1-3-13-36/h4-11,16,38H,1-3,12-15H2
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PubMed
71 -37.4n/an/a 40n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19453
PNG
(4-[3-phenyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a...)
Show SMILES Oc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccccc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-4-2-1-3-5-11)17(28-29)12-6-8-13(30)9-7-12/h1-10,30H
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PubMed
122 -36.2n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19452
PNG
(4-[2-phenyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a...)
Show SMILES Oc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-6-8-13(30)9-7-11)17(28-29)12-4-2-1-3-5-12/h1-10,30H
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PubMed
139 -35.9n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19458
PNG
(4-(2-{4-[2-(dimethylamino)ethoxy]phenyl}-5,7-bis(t...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(O)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C24H20F6N4O2/c1-33(2)11-12-36-17-9-5-15(6-10-17)21-20(14-3-7-16(35)8-4-14)22-31-18(23(25,26)27)13-19(24(28,29)30)34(22)32-21/h3-10,13,35H,11-12H2,1-2H3
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PubMed
156 -35.6n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19456
PNG
(4-(3-{4-[2-(dimethylamino)ethoxy]phenyl}-5,7-bis(t...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccc(O)cc1
Show InChI InChI=1S/C24H20F6N4O2/c1-33(2)11-12-36-17-9-5-14(6-10-17)20-21(15-3-7-16(35)8-4-15)32-34-19(24(28,29)30)13-18(23(25,26)27)31-22(20)34/h3-10,13,35H,11-12H2,1-2H3
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PubMed
178 -35.3n/an/a 250n/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19457
PNG
(4-(2-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-5,7-bis(...)
Show SMILES Oc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C27H24F6N4O2/c28-26(29,30)21-16-22(27(31,32)33)37-25(34-21)23(17-4-8-19(38)9-5-17)24(35-37)18-6-10-20(11-7-18)39-15-14-36-12-2-1-3-13-36/h4-11,16,38H,1-3,12-15H2
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PubMed
192 -35.1n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19457
PNG
(4-(2-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-5,7-bis(...)
Show SMILES Oc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C27H24F6N4O2/c28-26(29,30)21-16-22(27(31,32)33)37-25(34-21)23(17-4-8-19(38)9-5-17)24(35-37)18-6-10-20(11-7-18)39-15-14-36-12-2-1-3-13-36/h4-11,16,38H,1-3,12-15H2
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PubMed
266 -34.4n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19458
PNG
(4-(2-{4-[2-(dimethylamino)ethoxy]phenyl}-5,7-bis(t...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nn2c(cc(nc2c1-c1ccc(O)cc1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C24H20F6N4O2/c1-33(2)11-12-36-17-9-5-15(6-10-17)21-20(14-3-7-16(35)8-4-14)22-31-18(23(25,26)27)13-19(24(28,29)30)34(22)32-21/h3-10,13,35H,11-12H2,1-2H3
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PubMed
408 -33.4n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM19451
PNG
(2,3-bis(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-6...)
Show SMILES Oc1ccc(cc1)-c1nn2cc(O)cnc2c1-c1ccc(O)cc1
Show InChI InChI=1S/C18H13N3O3/c22-13-5-1-11(2-6-13)16-17(12-3-7-14(23)8-4-12)20-21-10-15(24)9-19-18(16)21/h1-10,22-24H
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PubMed
1.52E+3 -30.4n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19452
PNG
(4-[2-phenyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a...)
Show SMILES Oc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-6-8-13(30)9-7-11)17(28-29)12-4-2-1-3-5-12/h1-10,30H
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PubMed
2.22E+3 -29.6n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM19451
PNG
(2,3-bis(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-6...)
Show SMILES Oc1ccc(cc1)-c1nn2cc(O)cnc2c1-c1ccc(O)cc1
Show InChI InChI=1S/C18H13N3O3/c22-13-5-1-11(2-6-13)16-17(12-3-7-14(23)8-4-12)20-21-10-15(24)9-19-18(16)21/h1-10,22-24H
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3.33E+3 -28.6n/an/an/an/an/a7.50



University of Illinois at Urbana



Assay Description
Relative binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer, and purified full-length human ...


J Med Chem 50: 399-403 (2007)


Article DOI: 10.1021/jm061035y
BindingDB Entry DOI: 10.7270/Q2QZ288F
More data for this
Ligand-Target Pair