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Compile Data Set for Download or QSAR

Found 147 hits from deCODE Chemistry, Inc   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254766
PNG
(2-(3-(2,4-dichlorophenylthio)-1H-indol-4-yloxy)-N-...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)cc3Cl)c12
Show InChI InChI=1S/C20H12Cl4N2O4S3/c21-10-4-5-15(11(22)6-10)31-16-8-25-13-2-1-3-14(19(13)16)30-9-17(27)26-33(28,29)18-7-12(23)20(24)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 0.200n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254687
PNG
(CHEMBL464032 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C24H16Cl2N2O4S3/c25-17-11-22(34-24(17)26)35(30,31)28-21(29)13-32-19-7-3-6-18-23(19)20(12-27-18)33-16-9-8-14-4-1-2-5-15(14)10-16/h1-12,27H,13H2,(H,28,29)
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n/an/a 0.300n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254841
PNG
(2-(3-(3,4-dichlorophenylthio)-1H-indol-4-yloxy)-N-...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)c(Cl)c3)c12
Show InChI InChI=1S/C20H12Cl4N2O4S3/c21-11-5-4-10(6-12(11)22)31-16-8-25-14-2-1-3-15(19(14)16)30-9-17(27)26-33(28,29)18-7-13(23)20(24)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 0.300n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Antagonist activity at human EP3 receptor assessed as cAMP production by cell-based assay


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254883
PNG
(CHEMBL479434 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES COc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)cc1
Show InChI InChI=1S/C21H16Cl2N2O5S3/c1-29-12-5-7-13(8-6-12)31-17-10-24-15-3-2-4-16(20(15)17)30-11-18(26)25-33(27,28)19-9-14(22)21(23)32-19/h2-10,24H,11H2,1H3,(H,25,26)
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n/an/a 0.5n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254520
PNG
(CHEMBL466184 | N-(3,4-difluorophenylsulfonyl)-2-(3...)
Show SMILES Fc1ccc(cc1F)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H18F2N2O4S2/c27-20-11-10-19(13-21(20)28)36(32,33)30-25(31)15-34-23-7-3-6-22-26(23)24(14-29-22)35-18-9-8-16-4-1-2-5-17(16)12-18/h1-14,29H,15H2,(H,30,31)
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n/an/a 0.700n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254728
PNG
(CHEMBL465947 | N-(4-methoxyphenylsulfonyl)-2-(3-(n...)
Show SMILES COc1ccc(cc1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C27H22N2O5S2/c1-33-20-10-13-22(14-11-20)36(31,32)29-26(30)17-34-24-8-4-7-23-27(24)25(16-28-23)35-21-12-9-18-5-2-3-6-19(18)15-21/h2-16,28H,17H2,1H3,(H,29,30)
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n/an/a 0.700n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254647
PNG
(2-(3-(3,4-dichlorophenylsulfonyl)-1H-indol-4-yloxy...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H12Cl4N2O6S3/c21-11-5-4-10(6-12(11)22)34(28,29)16-8-25-14-2-1-3-15(19(14)16)32-9-17(27)26-35(30,31)18-7-13(23)20(24)33-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 1n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Antagonist activity at human EP3 receptor assessed as cAMP production by cell-based assay


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311615
PNG
(4,5-dichloro-N-(5-(5-fluoro-3-methyl-1-(naphthalen...)
Show SMILES Cc1cn(Cc2ccc3ccccc3c2)c2c(cc(F)cc12)-c1cc(NS(=O)(=O)c2cc(Cl)c(Cl)s2)no1
Show InChI InChI=1S/C27H18Cl2FN3O3S2/c1-15-13-33(14-16-6-7-17-4-2-3-5-18(17)8-16)26-20(15)9-19(30)10-21(26)23-12-24(31-36-23)32-38(34,35)25-11-22(28)27(29)37-25/h2-13H,14H2,1H3,(H,31,32)
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n/an/a 1n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311621
PNG
(3,4-dichloro-N-(5-(1-(2,4-dichlorobenzyl)-5-fluoro...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1cc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)no1
Show InChI InChI=1S/C25H16Cl4FN3O3S/c1-13-11-33(12-14-2-3-15(26)6-21(14)28)25-18(13)7-16(30)8-19(25)23-10-24(31-36-23)32-37(34,35)17-4-5-20(27)22(29)9-17/h2-11H,12H2,1H3,(H,31,32)
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n/an/a 1n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311623
PNG
(CHEMBL1081186 | N-(5-(1-(2,4-dichlorobenzyl)-5-flu...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1cc(NS(=O)(=O)c2ccc(F)c(F)c2)no1
Show InChI InChI=1S/C25H16Cl2F3N3O3S/c1-13-11-33(12-14-2-3-15(26)6-20(14)27)25-18(13)7-16(28)8-19(25)23-10-24(31-36-23)32-37(34,35)17-4-5-21(29)22(30)9-17/h2-11H,12H2,1H3,(H,31,32)
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n/an/a 1n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311624
PNG
(3,4-difluoro-N-(5-(5-fluoro-3-methyl-1-(naphthalen...)
Show SMILES Cc1cn(Cc2ccc3ccccc3c2)c2c(cc(F)cc12)-c1cc(NS(=O)(=O)c2ccc(F)c(F)c2)no1
Show InChI InChI=1S/C29H20F3N3O3S/c1-17-15-35(16-18-6-7-19-4-2-3-5-20(19)10-18)29-23(17)11-21(30)12-24(29)27-14-28(33-38-27)34-39(36,37)22-8-9-25(31)26(32)13-22/h2-15H,16H2,1H3,(H,33,34)
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n/an/a 1n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254841
PNG
(2-(3-(3,4-dichlorophenylthio)-1H-indol-4-yloxy)-N-...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)c(Cl)c3)c12
Show InChI InChI=1S/C20H12Cl4N2O4S3/c21-11-5-4-10(6-12(11)22)31-16-8-25-14-2-1-3-15(19(14)16)30-9-17(27)26-33(28,29)18-7-13(23)20(24)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 1.10n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254640
PNG
(CHEMBL482379 | N-(2,5-dimethoxyphenylsulfonyl)-2-(...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C28H24N2O6S2/c1-34-20-11-13-23(35-2)26(15-20)38(32,33)30-27(31)17-36-24-9-5-8-22-28(24)25(16-29-22)37-21-12-10-18-6-3-4-7-19(18)14-21/h3-16,29H,17H2,1-2H3,(H,30,31)
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n/an/a 1.20n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254768
PNG
(CHEMBL518396 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Cc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)c(C)c1
Show InChI InChI=1S/C22H18Cl2N2O4S3/c1-12-6-7-17(13(2)8-12)31-18-10-25-15-4-3-5-16(21(15)18)30-11-19(27)26-33(28,29)20-9-14(23)22(24)32-20/h3-10,25H,11H2,1-2H3,(H,26,27)
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n/an/a 1.30n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254841
PNG
(2-(3-(3,4-dichlorophenylthio)-1H-indol-4-yloxy)-N-...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)c(Cl)c3)c12
Show InChI InChI=1S/C20H12Cl4N2O4S3/c21-11-5-4-10(6-12(11)22)31-16-8-25-14-2-1-3-15(19(14)16)30-9-17(27)26-33(28,29)18-7-13(23)20(24)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 1.30n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254641
PNG
(CHEMBL482380 | N-(2-chlorophenylsulfonyl)-2-(3-(na...)
Show SMILES Clc1ccccc1S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H19ClN2O4S2/c27-20-8-3-4-11-24(20)35(31,32)29-25(30)16-33-22-10-5-9-21-26(22)23(15-28-21)34-19-13-12-17-6-1-2-7-18(17)14-19/h1-15,28H,16H2,(H,29,30)
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n/an/a 1.40n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254880
PNG
(CHEMBL520741 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES COc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)cc1OC
Show InChI InChI=1S/C22H18Cl2N2O6S3/c1-30-15-7-6-12(8-17(15)31-2)33-18-10-25-14-4-3-5-16(21(14)18)32-11-19(27)26-35(28,29)20-9-13(23)22(24)34-20/h3-10,25H,11H2,1-2H3,(H,26,27)
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n/an/a 1.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50255058
PNG
(CHEMBL479427 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H16Cl2N2O6S3/c25-17-11-22(35-24(17)26)37(32,33)28-21(29)13-34-19-7-3-6-18-23(19)20(12-27-18)36(30,31)16-9-8-14-4-1-2-5-15(14)10-16/h1-12,27H,13H2,(H,28,29)
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n/an/a 1.70n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254797
PNG
(2-(3-(2-chloro-4-fluorophenylthio)-1H-indol-4-ylox...)
Show SMILES Fc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)c(Cl)c1
Show InChI InChI=1S/C20H12Cl3FN2O4S3/c21-11-6-10(24)4-5-15(11)31-16-8-25-13-2-1-3-14(19(13)16)30-9-17(27)26-33(28,29)18-7-12(22)20(23)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 1.80n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254767
PNG
(CHEMBL464271 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Fc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)c(F)c1
Show InChI InChI=1S/C20H12Cl2F2N2O4S3/c21-11-7-18(32-20(11)22)33(28,29)26-17(27)9-30-14-3-1-2-13-19(14)16(8-25-13)31-15-5-4-10(23)6-12(15)24/h1-8,25H,9H2,(H,26,27)
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n/an/a 1.90n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254520
PNG
(CHEMBL466184 | N-(3,4-difluorophenylsulfonyl)-2-(3...)
Show SMILES Fc1ccc(cc1F)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H18F2N2O4S2/c27-20-11-10-19(13-21(20)28)36(32,33)30-25(31)15-34-23-7-3-6-22-26(23)24(14-29-22)35-18-9-8-16-4-1-2-5-17(16)12-18/h1-14,29H,15H2,(H,30,31)
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n/an/a 2n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311610
PNG
(4,5-dichloro-N-(5-(1-(2,4-dichlorobenzyl)-5-fluoro...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1ccc(NS(=O)(=O)c2cc(Cl)c(Cl)s2)nc1
Show InChI InChI=1S/C25H16Cl4FN3O2S2/c1-13-11-33(12-15-2-4-16(26)6-20(15)27)24-18(13)7-17(30)8-19(24)14-3-5-22(31-10-14)32-37(34,35)23-9-21(28)25(29)36-23/h2-11H,12H2,1H3,(H,31,32)
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n/an/a 2n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311619
PNG
(CHEMBL1080106 | N-(5-(1-(2,4-dichlorobenzyl)-5-flu...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1nnc(NS(=O)(=O)c2cc(F)c(F)cc2F)o1
Show InChI InChI=1S/C24H14Cl2F4N4O3S/c1-11-9-34(10-12-2-3-13(25)4-17(12)26)22-15(11)5-14(27)6-16(22)23-31-32-24(37-23)33-38(35,36)21-8-19(29)18(28)7-20(21)30/h2-9H,10H2,1H3,(H,32,33)
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n/an/a 2n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254686
PNG
(CHEMBL464031 | N-(3-chlorophenylsulfonyl)-2-(3-(na...)
Show SMILES Clc1cccc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H19ClN2O4S2/c27-19-7-3-8-21(14-19)35(31,32)29-25(30)16-33-23-10-4-9-22-26(23)24(15-28-22)34-20-12-11-17-5-1-2-6-18(17)13-20/h1-15,28H,16H2,(H,29,30)
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n/an/a 2n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostanoid EP3 Receptor


(Mus musculus (Mouse))
BDBM50254647
PNG
(2-(3-(3,4-dichlorophenylsulfonyl)-1H-indol-4-yloxy...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H12Cl4N2O6S3/c21-11-5-4-10(6-12(11)22)34(28,29)16-8-25-14-2-1-3-15(19(14)16)32-9-17(27)26-35(30,31)18-7-13(23)20(24)33-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 2n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from mouse EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254730
PNG
(2-(3-(naphthalen-2-ylthio)-1H-indol-4-yloxy)-N-(ph...)
Show SMILES O=C(COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H20N2O4S2/c29-25(28-34(30,31)21-9-2-1-3-10-21)17-32-23-12-6-11-22-26(23)24(16-27-22)33-20-14-13-18-7-4-5-8-19(18)15-20/h1-16,27H,17H2,(H,28,29)
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n/an/a 2.20n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254686
PNG
(CHEMBL464031 | N-(3-chlorophenylsulfonyl)-2-(3-(na...)
Show SMILES Clc1cccc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H19ClN2O4S2/c27-19-7-3-8-21(14-19)35(31,32)29-25(30)16-33-23-10-4-9-22-26(23)24(15-28-22)34-20-12-11-17-5-1-2-6-18(17)13-20/h1-15,28H,16H2,(H,29,30)
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n/an/a 2.20n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254643
PNG
(CHEMBL481589 | N-(3,5-dichlorophenylsulfonyl)-2-(3...)
Show SMILES Clc1cc(Cl)cc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H18Cl2N2O4S2/c27-18-11-19(28)13-21(12-18)36(32,33)30-25(31)15-34-23-7-3-6-22-26(23)24(14-29-22)35-20-9-8-16-4-1-2-5-17(16)10-20/h1-14,29H,15H2,(H,30,31)
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n/an/a 2.30n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254924
PNG
(CHEMBL465923 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Cn1c(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)nc2ccccc12
Show InChI InChI=1S/C22H16Cl2N4O4S3/c1-28-15-7-3-2-5-13(15)26-22(28)33-17-10-25-14-6-4-8-16(20(14)17)32-11-18(29)27-35(30,31)19-9-12(23)21(24)34-19/h2-10,25H,11H2,1H3,(H,27,29)
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n/an/a 2.5n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254797
PNG
(2-(3-(2-chloro-4-fluorophenylthio)-1H-indol-4-ylox...)
Show SMILES Fc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)c(Cl)c1
Show InChI InChI=1S/C20H12Cl3FN2O4S3/c21-11-6-10(24)4-5-15(11)31-16-8-25-13-2-1-3-14(19(13)16)30-9-17(27)26-33(28,29)18-7-12(22)20(23)32-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 2.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254838
PNG
(CHEMBL481582 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccccn3)c12
Show InChI InChI=1S/C19H13Cl2N3O4S3/c20-11-8-17(30-19(11)21)31(26,27)24-15(25)10-28-13-5-3-4-12-18(13)14(9-23-12)29-16-6-1-2-7-22-16/h1-9,23H,10H2,(H,24,25)
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n/an/a 2.80n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254642
PNG
(2-(3-(naphthalen-2-ylthio)-1H-indol-4-yloxy)-N-(th...)
Show SMILES O=C(COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12)NS(=O)(=O)c1cccs1
Show InChI InChI=1S/C24H18N2O4S3/c27-22(26-33(28,29)23-9-4-12-31-23)15-30-20-8-3-7-19-24(20)21(14-25-19)32-18-11-10-16-5-1-2-6-17(16)13-18/h1-14,25H,15H2,(H,26,27)
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n/an/a 3n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254473
PNG
(4,5-Dichlorothiophene-2-sulfonic Acid[2-(3-Naphtha...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Cc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C25H18Cl2N2O4S2/c26-19-12-23(34-25(19)27)35(31,32)29-22(30)14-33-21-7-3-6-20-24(21)18(13-28-20)11-15-8-9-16-4-1-2-5-17(16)10-15/h1-10,12-13,28H,11,14H2,(H,29,30)
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n/an/a 3n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311618
PNG
(CHEMBL1080105 | N-(5-(1-(2,4-dichlorobenzyl)-5-flu...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1cc(NS(=O)(=O)c2cc(F)c(F)cc2F)no1
Show InChI InChI=1S/C25H15Cl2F4N3O3S/c1-12-10-34(11-13-2-3-14(26)4-18(13)27)25-16(12)5-15(28)6-17(25)22-9-24(32-37-22)33-38(35,36)23-8-20(30)19(29)7-21(23)31/h2-10H,11H2,1H3,(H,32,33)
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n/an/a 3n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254882
PNG
(2-(3-(4-chlorophenylthio)-1H-indol-4-yloxy)-N-(4,5...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)cc3)c12
Show InChI InChI=1S/C20H13Cl3N2O4S3/c21-11-4-6-12(7-5-11)30-16-9-24-14-2-1-3-15(19(14)16)29-10-17(26)25-32(27,28)18-8-13(22)20(23)31-18/h1-9,24H,10H2,(H,25,26)
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n/an/a 3.40n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254964
PNG
(CHEMBL517180 | N-(3,4-difluorophenylsulfonyl)-2-(3...)
Show SMILES Fc1ccc(cc1F)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H18F2N2O6S2/c27-20-11-10-19(13-21(20)28)38(34,35)30-25(31)15-36-23-7-3-6-22-26(23)24(14-29-22)37(32,33)18-9-8-16-4-1-2-5-17(16)12-18/h1-14,29H,15H2,(H,30,31)
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n/an/a 3.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254643
PNG
(CHEMBL481589 | N-(3,5-dichlorophenylsulfonyl)-2-(3...)
Show SMILES Clc1cc(Cl)cc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H18Cl2N2O4S2/c27-18-11-19(28)13-21(12-18)36(32,33)30-25(31)15-34-23-7-3-6-22-26(23)24(14-29-22)35-20-9-8-16-4-1-2-5-17(16)10-20/h1-14,29H,15H2,(H,30,31)
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n/an/a 3.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254881
PNG
(2-(3-(4-(2-amino-2-oxoethyl)phenylthio)-1H-indol-4...)
Show SMILES NC(=O)Cc1ccc(Sc2c[nH]c3cccc(OCC(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)c23)cc1
Show InChI InChI=1S/C22H17Cl2N3O5S3/c23-14-9-20(34-22(14)24)35(30,31)27-19(29)11-32-16-3-1-2-15-21(16)17(10-26-15)33-13-6-4-12(5-7-13)8-18(25)28/h1-7,9-10,26H,8,11H2,(H2,25,28)(H,27,29)
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n/an/a 3.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254729
PNG
(CHEMBL517165 | N-(5-chlorothiophen-2-ylsulfonyl)-2...)
Show SMILES Clc1ccc(s1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C24H17ClN2O4S3/c25-21-10-11-23(33-21)34(29,30)27-22(28)14-31-19-7-3-6-18-24(19)20(13-26-18)32-17-9-8-15-4-1-2-5-16(15)12-17/h1-13,26H,14H2,(H,27,28)
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n/an/a 3.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254647
PNG
(2-(3-(3,4-dichlorophenylsulfonyl)-1H-indol-4-yloxy...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H12Cl4N2O6S3/c21-11-5-4-10(6-12(11)22)34(28,29)16-8-25-14-2-1-3-15(19(14)16)32-9-17(27)26-35(30,31)18-7-13(23)20(24)33-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 3.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254839
PNG
(CHEMBL520933 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4n3)c12
Show InChI InChI=1S/C23H15Cl2N3O4S3/c24-14-10-21(34-23(14)25)35(30,31)28-19(29)12-32-17-7-3-6-16-22(17)18(11-26-16)33-20-9-8-13-4-1-2-5-15(13)27-20/h1-11,26H,12H2,(H,28,29)
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n/an/a 3.90n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50255026
PNG
(CHEMBL480992 | N-(3,5-difluorophenylsulfonyl)-2-(3...)
Show SMILES Fc1cc(F)cc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H18F2N2O6S2/c27-18-11-19(28)13-21(12-18)38(34,35)30-25(31)15-36-23-7-3-6-22-26(23)24(14-29-22)37(32,33)20-9-8-16-4-1-2-5-17(16)10-20/h1-14,29H,15H2,(H,30,31)
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n/an/a 3.90n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50311622
PNG
(3,4-dichloro-N-(5-(1-(2,4-dichlorobenzyl)-5-fluoro...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(cc(F)cc12)-c1nnc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)o1
Show InChI InChI=1S/C24H15Cl4FN4O3S/c1-12-10-33(11-13-2-3-14(25)6-20(13)27)22-17(12)7-15(29)8-18(22)23-30-31-24(36-23)32-37(34,35)16-4-5-19(26)21(28)9-16/h2-10H,11H2,1H3,(H,31,32)
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n/an/a 4n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254882
PNG
(2-(3-(4-chlorophenylthio)-1H-indol-4-yloxy)-N-(4,5...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc(Cl)cc3)c12
Show InChI InChI=1S/C20H13Cl3N2O4S3/c21-11-4-6-12(7-5-11)30-16-9-24-14-2-1-3-15(19(14)16)29-10-17(26)25-32(27,28)18-8-13(22)20(23)31-18/h1-9,24H,10H2,(H,25,26)
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n/an/a 4.10n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254684
PNG
(CHEMBL481004 | N-(3,5-difluorophenylsulfonyl)-2-(3...)
Show SMILES Fc1cc(F)cc(c1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C26H18F2N2O4S2/c27-18-11-19(28)13-21(12-18)36(32,33)30-25(31)15-34-23-7-3-6-22-26(23)24(14-29-22)35-20-9-8-16-4-1-2-5-17(16)10-20/h1-14,29H,15H2,(H,30,31)
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n/an/a 4.20n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254729
PNG
(CHEMBL517165 | N-(5-chlorothiophen-2-ylsulfonyl)-2...)
Show SMILES Clc1ccc(s1)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4c3)c12
Show InChI InChI=1S/C24H17ClN2O4S3/c25-21-10-11-23(33-21)34(29,30)27-22(28)14-31-19-7-3-6-18-24(19)20(13-26-18)32-17-9-8-15-4-1-2-5-16(15)12-17/h1-13,26H,14H2,(H,27,28)
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n/an/a 4.5n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50303662
PNG
(3-(1-(2,4-dichlorobenzyl)-5-fluoro-3-methyl-1H-ind...)
Show SMILES Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(\C=C\C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)cc(F)cc12
Show InChI InChI=1S/C23H15Cl4FN2O3S2/c1-12-10-30(11-14-2-4-15(24)7-18(14)25)22-13(6-16(28)8-17(12)22)3-5-20(31)29-35(32,33)21-9-19(26)23(27)34-21/h2-10H,11H2,1H3,(H,29,31)/b5-3+
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n/an/a 4.60n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 6797-800 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.084
BindingDB Entry DOI: 10.7270/Q2833S51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254839
PNG
(CHEMBL520933 | N-(4,5-dichlorothiophen-2-ylsulfony...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(Sc3ccc4ccccc4n3)c12
Show InChI InChI=1S/C23H15Cl2N3O4S3/c24-14-10-21(34-23(14)25)35(30,31)28-19(29)12-32-17-7-3-6-16-22(17)18(11-26-16)33-20-9-8-13-4-1-2-5-15(13)27-20/h1-11,26H,12H2,(H,28,29)
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n/an/a 4.70n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254647
PNG
(2-(3-(3,4-dichlorophenylsulfonyl)-1H-indol-4-yloxy...)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)NC(=O)COc1cccc2[nH]cc(c12)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H12Cl4N2O6S3/c21-11-5-4-10(6-12(11)22)34(28,29)16-8-25-14-2-1-3-15(19(14)16)32-9-17(27)26-35(30,31)18-7-13(23)20(24)33-18/h1-8,25H,9H2,(H,26,27)
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n/an/a 4.70n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50254689
PNG
(2-(3-(4-(2-amino-2-oxoethyl)phenylsulfonyl)-1H-ind...)
Show SMILES NC(=O)Cc1ccc(cc1)S(=O)(=O)c1c[nH]c2cccc(OCC(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)c12
Show InChI InChI=1S/C22H17Cl2N3O7S3/c23-14-9-20(35-22(14)24)37(32,33)27-19(29)11-34-16-3-1-2-15-21(16)17(10-26-15)36(30,31)13-6-4-12(5-7-13)8-18(25)28/h1-7,9-10,26H,8,11H2,(H2,25,28)(H,27,29)
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n/an/a 5n/an/an/an/an/an/a



deCODE Chemistry, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor in presence of 10% human serum


Bioorg Med Chem Lett 19: 123-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.007
BindingDB Entry DOI: 10.7270/Q2JH3M1S
More data for this
Ligand-Target Pair
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