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Compile Data Set for Download or QSAR

Found 47 hits from EMD-Serono Research Institute   
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 EP4 subtype


(Homo sapiens (Human))
BDBM35847
PNG
((15S)-prostaglandin E2 | (5Z,11alpha,13E,15S)-11,1...)
Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1
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0.790n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM35847
PNG
((15S)-prostaglandin E2 | (5Z,11alpha,13E,15S)-11,1...)
Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1
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4.90n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224577
PNG
(4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-oxopy...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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13n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224575
PNG
((S)-4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-o...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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13n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224572
PNG
(4-(2-(2-(4-(3-chlorophenyl)-3-hydroxybutyl)-5-oxop...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Cl)c1
Show InChI InChI=1S/C22H25ClN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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18n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224570
PNG
((S)-4-(2-(2-(3-hydroxy-4-(3-iodophenyl)butyl)-5-ox...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(I)c1
Show InChI InChI=1S/C22H25IN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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26n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224574
PNG
(4-(2-(2-(3-hydroxy-4-(3-iodophenyl)butyl)-5-oxopyr...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(I)c1
Show InChI InChI=1S/C22H25IN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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27n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224586
PNG
(4-(2-(2-(4-(3-fluorophenyl)-3-hydroxybutyl)-5-oxop...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(F)c1
Show InChI InChI=1S/C22H25FN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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36n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224583
PNG
(4-(2-(2-(3-methyl-4-(3-phenethylphenyl)butyl)-5-ox...)
Show SMILES CC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(CCc2ccccc2)c1
Show InChI InChI=1S/C31H36N2O3/c1-24(22-28-9-5-8-27(23-28)11-10-25-6-3-2-4-7-25)16-19-32-20-18-30(34)33(32)21-17-26-12-14-29(15-13-26)31(35)36/h2-9,12-15,23-24H,10-11,16-22H2,1H3,(H,35,36)
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44n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224584
PNG
(4-(2-(2-(3-hydroxy-4-(3-(trifluoromethyl)phenyl)bu...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H25F3N2O4/c24-23(25,26)19-3-1-2-17(14-19)15-20(29)9-11-27-12-10-21(30)28(27)13-8-16-4-6-18(7-5-16)22(31)32/h1-7,14,20,29H,8-13,15H2,(H,31,32)
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57n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224581
PNG
(4-(2-(2-(3-hydroxy-4-(3-(trifluoromethoxy)phenyl)b...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H25F3N2O5/c24-23(25,26)33-20-3-1-2-17(15-20)14-19(29)9-11-27-12-10-21(30)28(27)13-8-16-4-6-18(7-5-16)22(31)32/h1-7,15,19,29H,8-14H2,(H,31,32)
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59n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224580
PNG
(4-(2-(2-(3-hydroxy-4-phenylbutyl)-5-oxopyrazolidin...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O4/c25-20(16-18-4-2-1-3-5-18)11-13-23-14-12-21(26)24(23)15-10-17-6-8-19(9-7-17)22(27)28/h1-9,20,25H,10-16H2,(H,27,28)
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68n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224578
PNG
((S)-4-(2-(2-(3-hydroxy-4-phenylbutyl)-5-oxopyrazol...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O4/c25-20(16-18-4-2-1-3-5-18)11-13-23-14-12-21(26)24(23)15-10-17-6-8-19(9-7-17)22(27)28/h1-9,20,25H,10-16H2,(H,27,28)/t20-/m1/s1
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134n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224571
PNG
(4-(2-(2-(3-hydroxyoctyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-2-3-4-5-18(23)11-13-21-14-12-19(24)22(21)15-10-16-6-8-17(9-7-16)20(25)26/h6-9,18,23H,2-5,10-15H2,1H3,(H,25,26)
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250n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224582
PNG
(4-(2-(2-(4-(3-(2-cyclopropylethyl)phenyl)-3-hydrox...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(CCC2CC2)c1
Show InChI InChI=1S/C27H34N2O4/c30-25(19-23-3-1-2-22(18-23)7-6-20-4-5-20)13-15-28-16-14-26(31)29(28)17-12-21-8-10-24(11-9-21)27(32)33/h1-3,8-11,18,20,25,30H,4-7,12-17,19H2,(H,32,33)
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330n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224583
PNG
(4-(2-(2-(3-methyl-4-(3-phenethylphenyl)butyl)-5-ox...)
Show SMILES CC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(CCc2ccccc2)c1
Show InChI InChI=1S/C31H36N2O3/c1-24(22-28-9-5-8-27(23-28)11-10-25-6-3-2-4-7-25)16-19-32-20-18-30(34)33(32)21-17-26-12-14-29(15-13-26)31(35)36/h2-9,12-15,23-24H,10-11,16-22H2,1H3,(H,35,36)
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560n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224579
PNG
(4-(2-(2-(4-hydroxy-4-(1-propylcyclobutyl)butyl)-5-...)
Show SMILES CCCC1(CCC1)C(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C23H34N2O4/c1-2-12-23(13-4-14-23)20(26)5-3-15-24-16-11-21(27)25(24)17-10-18-6-8-19(9-7-18)22(28)29/h6-9,20,26H,2-5,10-17H2,1H3,(H,28,29)
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750n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224576
PNG
(4-(2-(2-(4-hydroxynonyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C21H32N2O4/c1-2-3-4-6-19(24)7-5-14-22-15-13-20(25)23(22)16-12-17-8-10-18(11-9-17)21(26)27/h8-11,19,24H,2-7,12-16H2,1H3,(H,26,27)
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2.00E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224568
PNG
(4-(2-(2-(3-hydroxy-5-methylhexyl)-5-oxopyrazolidin...)
Show SMILES CC(C)CC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C19H28N2O4/c1-14(2)13-17(22)8-10-20-11-9-18(23)21(20)12-7-15-3-5-16(6-4-15)19(24)25/h3-6,14,17,22H,7-13H2,1-2H3,(H,24,25)
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2.00E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224570
PNG
((S)-4-(2-(2-(3-hydroxy-4-(3-iodophenyl)butyl)-5-ox...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(I)c1
Show InChI InChI=1S/C22H25IN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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2.03E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224571
PNG
(4-(2-(2-(3-hydroxyoctyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-2-3-4-5-18(23)11-13-21-14-12-19(24)22(21)15-10-16-6-8-17(9-7-16)20(25)26/h6-9,18,23H,2-5,10-15H2,1H3,(H,25,26)
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2.20E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224574
PNG
(4-(2-(2-(3-hydroxy-4-(3-iodophenyl)butyl)-5-oxopyr...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(I)c1
Show InChI InChI=1S/C22H25IN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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2.36E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224576
PNG
(4-(2-(2-(4-hydroxynonyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C21H32N2O4/c1-2-3-4-6-19(24)7-5-14-22-15-13-20(25)23(22)16-12-17-8-10-18(11-9-17)21(26)27/h8-11,19,24H,2-7,12-16H2,1H3,(H,26,27)
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2.44E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224569
PNG
(4-(2-(2-(3-hydroxy-4-methylheptyl)-5-oxopyrazolidi...)
Show SMILES CCCC(C)C(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-3-4-15(2)18(23)10-12-21-13-11-19(24)22(21)14-9-16-5-7-17(8-6-16)20(25)26/h5-8,15,18,23H,3-4,9-14H2,1-2H3,(H,25,26)
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2.76E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224581
PNG
(4-(2-(2-(3-hydroxy-4-(3-(trifluoromethoxy)phenyl)b...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H25F3N2O5/c24-23(25,26)33-20-3-1-2-17(15-20)14-19(29)9-11-27-12-10-21(30)28(27)13-8-16-4-6-18(7-5-16)22(31)32/h1-7,15,19,29H,8-14H2,(H,31,32)
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2.83E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224575
PNG
((S)-4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-o...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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3.07E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224568
PNG
(4-(2-(2-(3-hydroxy-5-methylhexyl)-5-oxopyrazolidin...)
Show SMILES CC(C)CC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C19H28N2O4/c1-14(2)13-17(22)8-10-20-11-9-18(23)21(20)12-7-15-3-5-16(6-4-15)19(24)25/h3-6,14,17,22H,7-13H2,1-2H3,(H,24,25)
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4.41E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224577
PNG
(4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-oxopy...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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5.45E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224572
PNG
(4-(2-(2-(4-(3-chlorophenyl)-3-hydroxybutyl)-5-oxop...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Cl)c1
Show InChI InChI=1S/C22H25ClN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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5.69E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224584
PNG
(4-(2-(2-(3-hydroxy-4-(3-(trifluoromethyl)phenyl)bu...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H25F3N2O4/c24-23(25,26)19-3-1-2-17(14-19)15-20(29)9-11-27-12-10-21(30)28(27)13-8-16-4-6-18(7-5-16)22(31)32/h1-7,14,20,29H,8-13,15H2,(H,31,32)
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6.00E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224569
PNG
(4-(2-(2-(3-hydroxy-4-methylheptyl)-5-oxopyrazolidi...)
Show SMILES CCCC(C)C(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-3-4-15(2)18(23)10-12-21-13-11-19(24)22(21)14-9-16-5-7-17(8-6-16)20(25)26/h5-8,15,18,23H,3-4,9-14H2,1-2H3,(H,25,26)
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6.00E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224580
PNG
(4-(2-(2-(3-hydroxy-4-phenylbutyl)-5-oxopyrazolidin...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O4/c25-20(16-18-4-2-1-3-5-18)11-13-23-14-12-21(26)24(23)15-10-17-6-8-19(9-7-17)22(27)28/h1-9,20,25H,10-16H2,(H,27,28)
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6.20E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224586
PNG
(4-(2-(2-(4-(3-fluorophenyl)-3-hydroxybutyl)-5-oxop...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(F)c1
Show InChI InChI=1S/C22H25FN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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6.29E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224582
PNG
(4-(2-(2-(4-(3-(2-cyclopropylethyl)phenyl)-3-hydrox...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(CCC2CC2)c1
Show InChI InChI=1S/C27H34N2O4/c30-25(19-23-3-1-2-22(18-23)7-6-20-4-5-20)13-15-28-16-14-26(31)29(28)17-12-21-8-10-24(11-9-21)27(32)33/h1-3,8-11,18,20,25,30H,4-7,12-17,19H2,(H,32,33)
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8.34E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224578
PNG
((S)-4-(2-(2-(3-hydroxy-4-phenylbutyl)-5-oxopyrazol...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O4/c25-20(16-18-4-2-1-3-5-18)11-13-23-14-12-21(26)24(23)15-10-17-6-8-19(9-7-17)22(27)28/h1-9,20,25H,10-16H2,(H,27,28)/t20-/m1/s1
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9.20E+3n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224579
PNG
(4-(2-(2-(4-hydroxy-4-(1-propylcyclobutyl)butyl)-5-...)
Show SMILES CCCC1(CCC1)C(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C23H34N2O4/c1-2-12-23(13-4-14-23)20(26)5-3-15-24-16-11-21(27)25(24)17-10-18-6-8-19(9-7-18)22(28)29/h6-9,20,26H,2-5,10-17H2,1H3,(H,28,29)
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>5.00E+4n/an/an/an/an/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Binding affinity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224572
PNG
(4-(2-(2-(4-(3-chlorophenyl)-3-hydroxybutyl)-5-oxop...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Cl)c1
Show InChI InChI=1S/C22H25ClN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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n/an/an/an/a 0.200n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224571
PNG
(4-(2-(2-(3-hydroxyoctyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-2-3-4-5-18(23)11-13-21-14-12-19(24)22(21)15-10-16-6-8-17(9-7-16)20(25)26/h6-9,18,23H,2-5,10-15H2,1H3,(H,25,26)
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n/an/an/an/a 595n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224568
PNG
(4-(2-(2-(3-hydroxy-5-methylhexyl)-5-oxopyrazolidin...)
Show SMILES CC(C)CC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C19H28N2O4/c1-14(2)13-17(22)8-10-20-11-9-18(23)21(20)12-7-15-3-5-16(6-4-15)19(24)25/h3-6,14,17,22H,7-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 1.50E+4n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224579
PNG
(4-(2-(2-(4-hydroxy-4-(1-propylcyclobutyl)butyl)-5-...)
Show SMILES CCCC1(CCC1)C(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C23H34N2O4/c1-2-12-23(13-4-14-23)20(26)5-3-15-24-16-11-21(27)25(24)17-10-18-6-8-19(9-7-18)22(28)29/h6-9,20,26H,2-5,10-17H2,1H3,(H,28,29)
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n/an/an/an/a 393n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224571
PNG
(4-(2-(2-(3-hydroxyoctyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-2-3-4-5-18(23)11-13-21-14-12-19(24)22(21)15-10-16-6-8-17(9-7-16)20(25)26/h6-9,18,23H,2-5,10-15H2,1H3,(H,25,26)
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n/an/an/an/a 5n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224577
PNG
(4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-oxopy...)
Show SMILES OC(CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)
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n/an/an/an/a 0.200n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224569
PNG
(4-(2-(2-(3-hydroxy-4-methylheptyl)-5-oxopyrazolidi...)
Show SMILES CCCC(C)C(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H30N2O4/c1-3-4-15(2)18(23)10-12-21-13-11-19(24)22(21)14-9-16-5-7-17(8-6-16)20(25)26/h5-8,15,18,23H,3-4,9-14H2,1-2H3,(H,25,26)
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n/an/an/an/a 5.00E+3n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224576
PNG
(4-(2-(2-(4-hydroxynonyl)-5-oxopyrazolidin-1-yl)eth...)
Show SMILES CCCCCC(O)CCCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C21H32N2O4/c1-2-3-4-6-19(24)7-5-14-22-15-13-20(25)23(22)16-12-17-8-10-18(11-9-17)21(26)27/h8-11,19,24H,2-7,12-16H2,1H3,(H,26,27)
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n/an/an/an/a 1.30E+3n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50224575
PNG
((S)-4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-o...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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n/an/an/an/a>1.00E+4n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP2 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224568
PNG
(4-(2-(2-(3-hydroxy-5-methylhexyl)-5-oxopyrazolidin...)
Show SMILES CC(C)CC(O)CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C19H28N2O4/c1-14(2)13-17(22)8-10-20-11-9-18(23)21(20)12-7-15-3-5-16(6-4-15)19(24)25/h3-6,14,17,22H,7-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 277n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50224575
PNG
((S)-4-(2-(2-(4-(3-bromophenyl)-3-hydroxybutyl)-5-o...)
Show SMILES O[C@H](CCN1CCC(=O)N1CCc1ccc(cc1)C(O)=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C22H25BrN2O4/c23-19-3-1-2-17(14-19)15-20(26)9-11-24-12-10-21(27)25(24)13-8-16-4-6-18(7-5-16)22(28)29/h1-7,14,20,26H,8-13,15H2,(H,28,29)/t20-/m1/s1
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n/an/an/an/a 0.100n/an/an/an/a



EMD-Serono Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human prostaglandin EP4 receptor


Bioorg Med Chem Lett 17: 6572-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.074
BindingDB Entry DOI: 10.7270/Q29887V9
More data for this
Ligand-Target Pair