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Compile Data Set for Download or QSAR

Found 50 hits Enz. Inhib. hit(s) with all data for entry = 50032749   
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
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334136
PNG
((S)-4-(1-(1-(biphenyl-4-ylmethyl)indoline-7-carbox...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)-c3ccccc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C31H28N2O3/c1-21(23-14-16-27(17-15-23)31(35)36)32-30(34)28-9-5-8-26-18-19-33(29(26)28)20-22-10-12-25(13-11-22)24-6-3-2-4-7-24/h2-17,21H,18-20H2,1H3,(H,32,34)(H,35,36)/t21-/m0/s1
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0.280n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334129
PNG
((S)-4-(1-(1-(3,5-dibromobenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cc(Br)cc(Br)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22Br2N2O3/c1-15(17-5-7-19(8-6-17)25(31)32)28-24(30)22-4-2-3-18-9-10-29(23(18)22)14-16-11-20(26)13-21(27)12-16/h2-8,11-13,15H,9-10,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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0.330n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334130
PNG
((S)-4-(1-(1-(3,4-dichlorobenzyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)c(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22Cl2N2O3/c1-15(17-6-8-19(9-7-17)25(31)32)28-24(30)20-4-2-3-18-11-12-29(23(18)20)14-16-5-10-21(26)22(27)13-16/h2-10,13,15H,11-12,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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0.340n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334149
PNG
((S)-4-(1-(5-fluoro-1-(4-(trifluoromethyl)benzyl)in...)
Show SMILES C[C@H](NC(=O)c1cc(F)cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22F4N2O3/c1-15(17-4-6-18(7-5-17)25(34)35)31-24(33)22-13-21(27)12-19-10-11-32(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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0.370n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334133
PNG
((S)-4-(1-(1-(4-(trifluoromethyl)benzyl)indoline-7-...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O3/c1-16(18-7-9-20(10-8-18)25(33)34)30-24(32)22-4-2-3-19-13-14-31(23(19)22)15-17-5-11-21(12-6-17)26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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0.370n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334147
PNG
((S)-4-(1-(5-chloro-1-(4-(trifluoromethyl)benzyl)in...)
Show SMILES C[C@H](NC(=O)c1cc(Cl)cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22ClF3N2O3/c1-15(17-4-6-18(7-5-17)25(34)35)31-24(33)22-13-21(27)12-19-10-11-32(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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0.400n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334128
PNG
((S)-4-(1-(1-(3-(trifluoromethyl)benzyl)indoline-7-...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O3/c1-16(18-8-10-20(11-9-18)25(33)34)30-24(32)22-7-3-5-19-12-13-31(23(19)22)15-17-4-2-6-21(14-17)26(27,28)29/h2-11,14,16H,12-13,15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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0.400n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334127
PNG
((S)-4-(1-(1-(3-chlorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23ClN2O3/c1-16(18-8-10-20(11-9-18)25(30)31)27-24(29)22-7-3-5-19-12-13-28(23(19)22)15-17-4-2-6-21(26)14-17/h2-11,14,16H,12-13,15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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0.440n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334131
PNG
((S)-4-(1-(1-(4-chlorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23ClN2O3/c1-16(18-7-9-20(10-8-18)25(30)31)27-24(29)22-4-2-3-19-13-14-28(23(19)22)15-17-5-11-21(26)12-6-17/h2-12,16H,13-15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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0.440n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334148
PNG
((S)-4-(1-(5-(trifluoromethyl)-1-(4-(trifluoromethy...)
Show SMILES C[C@H](NC(=O)c1cc(cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)C(F)(F)F)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C27H22F6N2O3/c1-15(17-4-6-18(7-5-17)25(37)38)34-24(36)22-13-21(27(31,32)33)12-19-10-11-35(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,34,36)(H,37,38)/t15-/m0/s1
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0.660n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334142
PNG
((S)-4-(1-(1-(4-methylbenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(C)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H26N2O3/c1-17-6-8-19(9-7-17)16-28-15-14-21-4-3-5-23(24(21)28)25(29)27-18(2)20-10-12-22(13-11-20)26(30)31/h3-13,18H,14-16H2,1-2H3,(H,27,29)(H,30,31)/t18-/m0/s1
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0.780n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334146
PNG
((S)-N-(1-(4-(2H-tetrazol-5-yl)phenyl)ethyl)-1-(4-(...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)-c1nnn[nH]1 |r|
Show InChI InChI=1S/C26H23F3N6O/c1-16(18-7-9-20(10-8-18)24-31-33-34-32-24)30-25(36)22-4-2-3-19-13-14-35(23(19)22)15-17-5-11-21(12-6-17)26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,36)(H,31,32,33,34)/t16-/m0/s1
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1n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334134
PNG
((S)-4-(1-(1-(4-(trifluoromethoxy)benzyl)indoline-7...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(OC(F)(F)F)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O4/c1-16(18-7-9-20(10-8-18)25(33)34)30-24(32)22-4-2-3-19-13-14-31(23(19)22)15-17-5-11-21(12-6-17)35-26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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1.5n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334132
PNG
((S)-4-(1-(1-(4-fluorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(F)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23FN2O3/c1-16(18-7-9-20(10-8-18)25(30)31)27-24(29)22-4-2-3-19-13-14-28(23(19)22)15-17-5-11-21(26)12-6-17/h2-12,16H,13-15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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1.80n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334138
PNG
((S)-4-(1-(1-(2-bromo-4-chlorobenzyl)indoline-7-car...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)cc3Br)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22BrClN2O3/c1-15(16-5-7-18(8-6-16)25(31)32)28-24(30)21-4-2-3-17-11-12-29(23(17)21)14-19-9-10-20(27)13-22(19)26/h2-10,13,15H,11-12,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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2.30n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50319847
PNG
((S)-4-(1-(1-(3-chlorobenzyl)-1H-indole-7-carboxami...)
Show SMILES C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H21ClN2O3/c1-16(18-8-10-20(11-9-18)25(30)31)27-24(29)22-7-3-5-19-12-13-28(23(19)22)15-17-4-2-6-21(26)14-17/h2-14,16H,15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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2.70n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334135
PNG
((S)-4-(1-(1-(4-cyanobenzyl)indoline-7-carboxamido)...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C#N)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23N3O3/c1-17(20-9-11-22(12-10-20)26(31)32)28-25(30)23-4-2-3-21-13-14-29(24(21)23)16-19-7-5-18(15-27)6-8-19/h2-12,17H,13-14,16H2,1H3,(H,28,30)(H,31,32)/t17-/m0/s1
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3.10n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334143
PNG
((S)-4-(1-(1-(2-bromo-4-(trifluoromethyl)benzyl)ind...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3Br)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22BrF3N2O3/c1-15(16-5-7-18(8-6-16)25(34)35)31-24(33)21-4-2-3-17-11-12-32(23(17)21)14-19-9-10-20(13-22(19)27)26(28,29)30/h2-10,13,15H,11-12,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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6.70n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334145
PNG
((S)-4-(1-(1-(3-cyanobenzyl)indoline-7-carboxamido)...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C#N)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23N3O3/c1-17(20-8-10-22(11-9-20)26(31)32)28-25(30)23-7-3-6-21-12-13-29(24(21)23)16-19-5-2-4-18(14-19)15-27/h2-11,14,17H,12-13,16H2,1H3,(H,28,30)(H,31,32)/t17-/m0/s1
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7.5n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334141
PNG
((S)-4-(1-(1-(4-tert-butylbenzyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(C)(C)C)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C29H32N2O3/c1-19(21-10-12-23(13-11-21)28(33)34)30-27(32)25-7-5-6-22-16-17-31(26(22)25)18-20-8-14-24(15-9-20)29(2,3)4/h5-15,19H,16-18H2,1-4H3,(H,30,32)(H,33,34)/t19-/m0/s1
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14n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334139
PNG
((S)-4-(1-(1-(4-carbamoylbenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(N)=O)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H25N3O4/c1-16(18-9-11-21(12-10-18)26(32)33)28-25(31)22-4-2-3-19-13-14-29(23(19)22)15-17-5-7-20(8-6-17)24(27)30/h2-12,16H,13-15H2,1H3,(H2,27,30)(H,28,31)(H,32,33)/t16-/m0/s1
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30n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334144
PNG
((S)-4-(1-(1-(3-carbamoylbenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C(N)=O)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H25N3O4/c1-16(18-8-10-20(11-9-18)26(32)33)28-25(31)22-7-3-5-19-12-13-29(23(19)22)15-17-4-2-6-21(14-17)24(27)30/h2-11,14,16H,12-13,15H2,1H3,(H2,27,30)(H,28,31)(H,32,33)/t16-/m0/s1
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30n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334137
PNG
((S)-4-(1-(1-(4-carboxybenzyl)indoline-7-carboxamid...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(O)=O)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H24N2O5/c1-16(18-9-11-21(12-10-18)26(32)33)27-24(29)22-4-2-3-19-13-14-28(23(19)22)15-17-5-7-20(8-6-17)25(30)31/h2-12,16H,13-15H2,1H3,(H,27,29)(H,30,31)(H,32,33)/t16-/m0/s1
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54n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334140
PNG
((S)-4-(1-(1-(pyridin-3-ylmethyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccnc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C24H23N3O3/c1-16(18-7-9-20(10-8-18)24(29)30)26-23(28)21-6-2-5-19-11-13-27(22(19)21)15-17-4-3-12-25-14-17/h2-10,12,14,16H,11,13,15H2,1H3,(H,26,28)(H,29,30)/t16-/m0/s1
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76n/an/an/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human prostanoid EP4 receptor expressed in HEK293-EBNA cells after 60 mins by scintillation counting


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334131
PNG
((S)-4-(1-(1-(4-chlorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23ClN2O3/c1-16(18-7-9-20(10-8-18)25(30)31)27-24(29)22-4-2-3-19-13-14-28(23(19)22)15-17-5-11-21(26)12-6-17/h2-12,16H,13-15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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n/an/a 0.920n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334130
PNG
((S)-4-(1-(1-(3,4-dichlorobenzyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)c(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22Cl2N2O3/c1-15(17-6-8-19(9-7-17)25(31)32)28-24(30)20-4-2-3-18-11-12-29(23(18)20)14-16-5-10-21(26)22(27)13-16/h2-10,13,15H,11-12,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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n/an/a 1.10n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334136
PNG
((S)-4-(1-(1-(biphenyl-4-ylmethyl)indoline-7-carbox...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)-c3ccccc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C31H28N2O3/c1-21(23-14-16-27(17-15-23)31(35)36)32-30(34)28-9-5-8-26-18-19-33(29(26)28)20-22-10-12-25(13-11-22)24-6-3-2-4-7-24/h2-17,21H,18-20H2,1H3,(H,32,34)(H,35,36)/t21-/m0/s1
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n/an/a 1.30n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334149
PNG
((S)-4-(1-(5-fluoro-1-(4-(trifluoromethyl)benzyl)in...)
Show SMILES C[C@H](NC(=O)c1cc(F)cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22F4N2O3/c1-15(17-4-6-18(7-5-17)25(34)35)31-24(33)22-13-21(27)12-19-10-11-32(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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n/an/a 2.10n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334133
PNG
((S)-4-(1-(1-(4-(trifluoromethyl)benzyl)indoline-7-...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O3/c1-16(18-7-9-20(10-8-18)25(33)34)30-24(32)22-4-2-3-19-13-14-31(23(19)22)15-17-5-11-21(12-6-17)26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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n/an/a 2.10n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334147
PNG
((S)-4-(1-(5-chloro-1-(4-(trifluoromethyl)benzyl)in...)
Show SMILES C[C@H](NC(=O)c1cc(Cl)cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22ClF3N2O3/c1-15(17-4-6-18(7-5-17)25(34)35)31-24(33)22-13-21(27)12-19-10-11-32(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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n/an/a 2.20n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334134
PNG
((S)-4-(1-(1-(4-(trifluoromethoxy)benzyl)indoline-7...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(OC(F)(F)F)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O4/c1-16(18-7-9-20(10-8-18)25(33)34)30-24(32)22-4-2-3-19-13-14-31(23(19)22)15-17-5-11-21(12-6-17)35-26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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n/an/a 2.80n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334148
PNG
((S)-4-(1-(5-(trifluoromethyl)-1-(4-(trifluoromethy...)
Show SMILES C[C@H](NC(=O)c1cc(cc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)C(F)(F)F)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C27H22F6N2O3/c1-15(17-4-6-18(7-5-17)25(37)38)34-24(36)22-13-21(27(31,32)33)12-19-10-11-35(23(19)22)14-16-2-8-20(9-3-16)26(28,29)30/h2-9,12-13,15H,10-11,14H2,1H3,(H,34,36)(H,37,38)/t15-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334146
PNG
((S)-N-(1-(4-(2H-tetrazol-5-yl)phenyl)ethyl)-1-(4-(...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(F)(F)F)c12)c1ccc(cc1)-c1nnn[nH]1 |r|
Show InChI InChI=1S/C26H23F3N6O/c1-16(18-7-9-20(10-8-18)24-31-33-34-32-24)30-25(36)22-4-2-3-19-13-14-35(23(19)22)15-17-5-11-21(12-6-17)26(27,28)29/h2-12,16H,13-15H2,1H3,(H,30,36)(H,31,32,33,34)/t16-/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334143
PNG
((S)-4-(1-(1-(2-bromo-4-(trifluoromethyl)benzyl)ind...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3Br)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H22BrF3N2O3/c1-15(16-5-7-18(8-6-16)25(34)35)31-24(33)21-4-2-3-17-11-12-32(23(17)21)14-19-9-10-20(13-22(19)27)26(28,29)30/h2-10,13,15H,11-12,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
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n/an/a 4.70n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334142
PNG
((S)-4-(1-(1-(4-methylbenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(C)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H26N2O3/c1-17-6-8-19(9-7-17)16-28-15-14-21-4-3-5-23(24(21)28)25(29)27-18(2)20-10-12-22(13-11-20)26(30)31/h3-13,18H,14-16H2,1-2H3,(H,27,29)(H,30,31)/t18-/m0/s1
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n/an/a 5.80n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50319847
PNG
((S)-4-(1-(1-(3-chlorobenzyl)-1H-indole-7-carboxami...)
Show SMILES C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H21ClN2O3/c1-16(18-8-10-20(11-9-18)25(30)31)27-24(29)22-7-3-5-19-12-13-28(23(19)22)15-17-4-2-6-21(26)14-17/h2-14,16H,15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334132
PNG
((S)-4-(1-(1-(4-fluorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(F)cc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23FN2O3/c1-16(18-7-9-20(10-8-18)25(30)31)27-24(29)22-4-2-3-19-13-14-28(23(19)22)15-17-5-11-21(26)12-6-17/h2-12,16H,13-15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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n/an/a 6.20n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334135
PNG
((S)-4-(1-(1-(4-cyanobenzyl)indoline-7-carboxamido)...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C#N)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23N3O3/c1-17(20-9-11-22(12-10-20)26(31)32)28-25(30)23-4-2-3-21-13-14-29(24(21)23)16-19-7-5-18(15-27)6-8-19/h2-12,17H,13-14,16H2,1H3,(H,28,30)(H,31,32)/t17-/m0/s1
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n/an/a 7.30n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334138
PNG
((S)-4-(1-(1-(2-bromo-4-chlorobenzyl)indoline-7-car...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(Cl)cc3Br)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22BrClN2O3/c1-15(16-5-7-18(8-6-16)25(31)32)28-24(30)21-4-2-3-17-11-12-29(23(17)21)14-19-9-10-20(27)13-22(19)26/h2-10,13,15H,11-12,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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n/an/a 8.30n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334144
PNG
((S)-4-(1-(1-(3-carbamoylbenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C(N)=O)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H25N3O4/c1-16(18-8-10-20(11-9-18)26(32)33)28-25(31)22-7-3-5-19-12-13-29(23(19)22)15-17-4-2-6-21(14-17)24(27)30/h2-11,14,16H,12-13,15H2,1H3,(H2,27,30)(H,28,31)(H,32,33)/t16-/m0/s1
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n/an/a 72n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334139
PNG
((S)-4-(1-(1-(4-carbamoylbenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(N)=O)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H25N3O4/c1-16(18-9-11-21(12-10-18)26(32)33)28-25(31)22-4-2-3-19-13-14-29(23(19)22)15-17-5-7-20(8-6-17)24(27)30/h2-12,16H,13-15H2,1H3,(H2,27,30)(H,28,31)(H,32,33)/t16-/m0/s1
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n/an/a 73n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334141
PNG
((S)-4-(1-(1-(4-tert-butylbenzyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3ccc(cc3)C(C)(C)C)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C29H32N2O3/c1-19(21-10-12-23(13-11-21)28(33)34)30-27(32)25-7-5-6-22-16-17-31(26(22)25)18-20-8-14-24(15-9-20)29(2,3)4/h5-15,19H,16-18H2,1-4H3,(H,30,32)(H,33,34)/t19-/m0/s1
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n/an/a 114n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334145
PNG
((S)-4-(1-(1-(3-cyanobenzyl)indoline-7-carboxamido)...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C#N)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23N3O3/c1-17(20-8-10-22(11-9-20)26(31)32)28-25(30)23-7-3-6-21-12-13-29(24(21)23)16-19-5-2-4-18(14-19)15-27/h2-11,14,17H,12-13,16H2,1H3,(H,28,30)(H,31,32)/t17-/m0/s1
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n/an/a 212n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334140
PNG
((S)-4-(1-(1-(pyridin-3-ylmethyl)indoline-7-carboxa...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccnc3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C24H23N3O3/c1-16(18-7-9-20(10-8-18)24(29)30)26-23(28)21-6-2-5-19-11-13-27(22(19)21)15-17-4-3-12-25-14-17/h2-10,12,14,16H,11,13,15H2,1H3,(H,26,28)(H,29,30)/t16-/m0/s1
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n/an/a 258n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334129
PNG
((S)-4-(1-(1-(3,5-dibromobenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cc(Br)cc(Br)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22Br2N2O3/c1-15(17-5-7-19(8-6-17)25(31)32)28-24(30)22-4-2-3-18-9-10-29(23(18)22)14-16-11-20(26)13-21(27)12-16/h2-8,11-13,15H,9-10,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334127
PNG
((S)-4-(1-(1-(3-chlorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23ClN2O3/c1-16(18-8-10-20(11-9-18)25(30)31)27-24(29)22-7-3-5-19-12-13-28(23(19)22)15-17-4-2-6-21(26)14-17/h2-11,14,16H,12-13,15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334128
PNG
((S)-4-(1-(1-(3-(trifluoromethyl)benzyl)indoline-7-...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O3/c1-16(18-8-10-20(11-9-18)25(33)34)30-24(32)22-7-3-5-19-12-13-31(23(19)22)15-17-4-2-6-21(14-17)26(27,28)29/h2-11,14,16H,12-13,15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-induced cAMP accumulation by scintillat...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334128
PNG
((S)-4-(1-(1-(3-(trifluoromethyl)benzyl)indoline-7-...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(c3)C(F)(F)F)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C26H23F3N2O3/c1-16(18-8-10-20(11-9-18)25(33)34)30-24(32)22-7-3-5-19-12-13-31(23(19)22)15-17-4-2-6-21(14-17)26(27,28)29/h2-11,14,16H,12-13,15H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1
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n/an/an/an/a 0.200n/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as potentiation of PGE2-induced cAMP accumulation by scintillati...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334127
PNG
((S)-4-(1-(1-(3-chlorobenzyl)indoline-7-carboxamido...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cccc(Cl)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H23ClN2O3/c1-16(18-8-10-20(11-9-18)25(30)31)27-24(29)22-7-3-5-19-12-13-28(23(19)22)15-17-4-2-6-21(26)14-17/h2-11,14,16H,12-13,15H2,1H3,(H,27,29)(H,30,31)/t16-/m0/s1
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n/an/an/an/a 0.820n/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as potentiation of PGE2-induced cAMP accumulation by scintillati...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50334129
PNG
((S)-4-(1-(1-(3,5-dibromobenzyl)indoline-7-carboxam...)
Show SMILES C[C@H](NC(=O)c1cccc2CCN(Cc3cc(Br)cc(Br)c3)c12)c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C25H22Br2N2O3/c1-15(17-5-7-19(8-6-17)25(31)32)28-24(30)22-4-2-3-18-9-10-29(23(18)22)14-16-11-20(26)13-21(27)12-16/h2-8,11-13,15H,9-10,14H2,1H3,(H,28,30)(H,31,32)/t15-/m0/s1
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n/an/an/an/a 0.360n/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human prostanoid EP4 receptor expressed in HEK293 cells assessed as potentiation of PGE2-induced cAMP accumulation by scintillati...


Bioorg Med Chem Lett 21: 484-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.106
BindingDB Entry DOI: 10.7270/Q2BZ6695
More data for this
Ligand-Target Pair