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Compile Data Set for Download or QSAR

Found 49 hits with Last Name = 'bristow' and Initial = 'ak'   
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 EP1 subtype


(Homo sapiens (Human))
BDBM50412231
PNG
(CHEMBL520438)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CO)cc1
Show InChI InChI=1S/C26H24ClN3O3/c1-18-13-24(26(32)28-23-10-7-19(16-31)8-11-23)29-30(18)15-21-14-22(27)9-12-25(21)33-17-20-5-3-2-4-6-20/h2-14,31H,15-17H2,1H3,(H,28,32)
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39.8n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412241
PNG
(CHEMBL495091)
Show SMILES CCN1CCc2ccc(cc2CC1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C28H35ClN4O2/c1-5-32-12-10-21-6-7-23(15-22(21)11-13-32)28(34)30-27-14-20(4)33(31-27)17-24-16-25(29)8-9-26(24)35-18-19(2)3/h6-9,14-16,19H,5,10-13,17-18H2,1-4H3,(H,30,31,34)
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50.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412224
PNG
(CHEMBL479591)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C30H31ClN4O3/c1-22-17-28(30(36)32-27-10-7-23(8-11-27)19-34-13-15-37-16-14-34)33-35(22)20-25-18-26(31)9-12-29(25)38-21-24-5-3-2-4-6-24/h2-12,17-18H,13-16,19-21H2,1H3,(H,32,36)
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79.4n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412232
PNG
(CHEMBL523216)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN(CCO)CCO)cc1
Show InChI InChI=1S/C27H35ClN4O4/c1-19(2)18-36-26-9-6-23(28)15-22(26)17-32-20(3)14-25(30-32)27(35)29-24-7-4-21(5-8-24)16-31(10-12-33)11-13-34/h4-9,14-15,19,33-34H,10-13,16-18H2,1-3H3,(H,29,35)
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79.4n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412239
PNG
(CHEMBL492237)
Show SMILES CNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCC(C)C)n2)cc1
Show InChI InChI=1S/C24H29ClN4O2/c1-16(2)15-31-23-10-7-20(25)12-19(23)14-29-17(3)11-22(28-29)24(30)27-21-8-5-18(6-9-21)13-26-4/h5-12,16,26H,13-15H2,1-4H3,(H,27,30)
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79.4n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412233
PNG
(CHEMBL495107)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CNCCO)cc1
Show InChI InChI=1S/C25H31ClN4O3/c1-17(2)16-33-24-9-6-21(26)13-20(24)15-30-18(3)12-23(29-30)25(32)28-22-7-4-19(5-8-22)14-27-10-11-31/h4-9,12-13,17,27,31H,10-11,14-16H2,1-3H3,(H,28,32)
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100n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412209
PNG
(CHEMBL494466)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(cc2)C2CCCN2)cc1C
Show InChI InChI=1S/C26H31ClN4O2/c1-17(2)16-33-24-11-10-22(27)14-21(24)15-31-18(3)13-25(30-31)29-26(32)20-8-6-19(7-9-20)23-5-4-12-28-23/h6-11,13-14,17,23,28H,4-5,12,15-16H2,1-3H3,(H,29,30,32)
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100n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412208
PNG
(CHEMBL493254)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc3CNCCc3c2)cc1C
Show InChI InChI=1S/C25H29ClN4O2/c1-16(2)15-32-23-7-6-22(26)12-21(23)14-30-17(3)10-24(29-30)28-25(31)19-4-5-20-13-27-9-8-18(20)11-19/h4-7,10-12,16,27H,8-9,13-15H2,1-3H3,(H,28,29,31)
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126n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412225
PNG
(CHEMBL480789)
Show SMILES CNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCc3ccccc3)n2)cc1
Show InChI InChI=1S/C27H27ClN4O2/c1-19-14-25(27(33)30-24-11-8-20(9-12-24)16-29-2)31-32(19)17-22-15-23(28)10-13-26(22)34-18-21-6-4-3-5-7-21/h3-15,29H,16-18H2,1-2H3,(H,30,33)
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126n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412215
PNG
(CHEMBL481870)
Show SMILES CCNCc1ccc(cc1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C25H31ClN4O2/c1-5-27-14-19-6-8-20(9-7-19)25(31)28-24-12-18(4)30(29-24)15-21-13-22(26)10-11-23(21)32-16-17(2)3/h6-13,17,27H,5,14-16H2,1-4H3,(H,28,29,31)
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158n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412213
PNG
(CHEMBL481689)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CN3CCCC3)cc2)cc1C
Show InChI InChI=1S/C27H33ClN4O2/c1-19(2)18-34-25-11-10-24(28)15-23(25)17-32-20(3)14-26(30-32)29-27(33)22-8-6-21(7-9-22)16-31-12-4-5-13-31/h6-11,14-15,19H,4-5,12-13,16-18H2,1-3H3,(H,29,30,33)
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158n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity of human PGE2 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium mobilisation by FLIPR assay


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412237
PNG
(CHEMBL492238)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN(C)C)cc1
Show InChI InChI=1S/C25H31ClN4O2/c1-17(2)16-32-24-11-8-21(26)13-20(24)15-30-18(3)12-23(28-30)25(31)27-22-9-6-19(7-10-22)14-29(4)5/h6-13,17H,14-16H2,1-5H3,(H,27,31)
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n/an/a 5.01n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412236
PNG
(CHEMBL494282)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C27H33ClN4O2/c1-19(2)18-34-26-11-8-23(28)15-22(26)17-32-20(3)14-25(30-32)27(33)29-24-9-6-21(7-10-24)16-31-12-4-5-13-31/h6-11,14-15,19H,4-5,12-13,16-18H2,1-3H3,(H,29,33)
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n/an/a 6.31n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412235
PNG
(CHEMBL493065)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C28H35ClN4O2/c1-20(2)19-35-27-12-9-24(29)16-23(27)18-33-21(3)15-26(31-33)28(34)30-25-10-7-22(8-11-25)17-32-13-5-4-6-14-32/h7-12,15-16,20H,4-6,13-14,17-19H2,1-3H3,(H,30,34)
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n/an/a 6.31n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412231
PNG
(CHEMBL520438)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CO)cc1
Show InChI InChI=1S/C26H24ClN3O3/c1-18-13-24(26(32)28-23-10-7-19(16-31)8-11-23)29-30(18)15-21-14-22(27)9-12-25(21)33-17-20-5-3-2-4-6-20/h2-14,31H,15-17H2,1H3,(H,28,32)
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n/an/a 6.31n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412229
PNG
(CHEMBL480950)
Show SMILES CN(C)Cc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCc3ccccc3)n2)cc1
Show InChI InChI=1S/C28H29ClN4O2/c1-20-15-26(28(34)30-25-12-9-21(10-13-25)17-32(2)3)31-33(20)18-23-16-24(29)11-14-27(23)35-19-22-7-5-4-6-8-22/h4-16H,17-19H2,1-3H3,(H,30,34)
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n/an/a 7.94n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412239
PNG
(CHEMBL492237)
Show SMILES CNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCC(C)C)n2)cc1
Show InChI InChI=1S/C24H29ClN4O2/c1-16(2)15-31-23-10-7-20(25)12-19(23)14-29-17(3)11-22(28-29)24(30)27-21-8-5-18(6-9-21)13-26-4/h5-12,16,26H,13-15H2,1-4H3,(H,27,30)
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n/an/a 7.94n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412238
PNG
(CHEMBL523158)
Show SMILES CCNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCC(C)C)n2)cc1
Show InChI InChI=1S/C25H31ClN4O2/c1-5-27-14-19-6-9-22(10-7-19)28-25(31)23-12-18(4)30(29-23)15-20-13-21(26)8-11-24(20)32-16-17(2)3/h6-13,17,27H,5,14-16H2,1-4H3,(H,28,31)
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n/an/a 7.94n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412234
PNG
(CHEMBL523679)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C27H33ClN4O3/c1-19(2)18-35-26-9-6-23(28)15-22(26)17-32-20(3)14-25(30-32)27(33)29-24-7-4-21(5-8-24)16-31-10-12-34-13-11-31/h4-9,14-15,19H,10-13,16-18H2,1-3H3,(H,29,33)
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n/an/a 7.94n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412226
PNG
(CHEMBL404525)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C([O-])=O
Show InChI InChI=1S/C19H17ClN2O3/c1-13-9-17(19(23)24)21-22(13)11-15-10-16(20)7-8-18(15)25-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,23,24)/p-1
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n/an/a 10n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412224
PNG
(CHEMBL479591)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C30H31ClN4O3/c1-22-17-28(30(36)32-27-10-7-23(8-11-27)19-34-13-15-37-16-14-34)33-35(22)20-25-18-26(31)9-12-29(25)38-21-24-5-3-2-4-6-24/h2-12,17-18H,13-16,19-21H2,1H3,(H,32,36)
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n/an/a 10n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412227
PNG
(CHEMBL480181)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C31H33ClN4O2/c1-23-18-29(31(37)33-28-13-10-24(11-14-28)20-35-16-6-3-7-17-35)34-36(23)21-26-19-27(32)12-15-30(26)38-22-25-8-4-2-5-9-25/h2,4-5,8-15,18-19H,3,6-7,16-17,20-22H2,1H3,(H,33,37)
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n/an/a 12.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412216
PNG
(CHEMBL447709)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CO)cc2)cc1C
Show InChI InChI=1S/C23H26ClN3O3/c1-15(2)14-30-21-9-8-20(24)11-19(21)12-27-16(3)10-22(26-27)25-23(29)18-6-4-17(13-28)5-7-18/h4-11,15,28H,12-14H2,1-3H3,(H,25,26,29)
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n/an/a 12.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412228
PNG
(CHEMBL479989)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C30H31ClN4O2/c1-22-17-28(30(36)32-27-12-9-23(10-13-27)19-34-15-5-6-16-34)33-35(22)20-25-18-26(31)11-14-29(25)37-21-24-7-3-2-4-8-24/h2-4,7-14,17-18H,5-6,15-16,19-21H2,1H3,(H,32,36)
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n/an/a 12.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412225
PNG
(CHEMBL480789)
Show SMILES CNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCc3ccccc3)n2)cc1
Show InChI InChI=1S/C27H27ClN4O2/c1-19-14-25(27(33)30-24-11-8-20(9-12-24)16-29-2)31-32(19)17-22-15-23(28)10-13-26(22)34-18-21-6-4-3-5-7-21/h3-15,29H,16-18H2,1-2H3,(H,30,33)
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n/an/a 12.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412230
PNG
(CHEMBL480790)
Show SMILES CCNCc1ccc(NC(=O)c2cc(C)n(Cc3cc(Cl)ccc3OCc3ccccc3)n2)cc1
Show InChI InChI=1S/C28H29ClN4O2/c1-3-30-17-21-9-12-25(13-10-21)31-28(34)26-15-20(2)33(32-26)18-23-16-24(29)11-14-27(23)35-19-22-7-5-4-6-8-22/h4-16,30H,3,17-19H2,1-2H3,(H,31,34)
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n/an/a 12.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412242
PNG
(CHEMBL254990)
Show SMILES Cc1cc(NC(=O)c2ccccc2)nn1Cc1cc(Cl)ccc1OCc1ccccc1
Show InChI InChI=1S/C25H22ClN3O2/c1-18-14-24(27-25(30)20-10-6-3-7-11-20)28-29(18)16-21-15-22(26)12-13-23(21)31-17-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,27,28,30)
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n/an/a 15.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412232
PNG
(CHEMBL523216)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CN(CCO)CCO)cc1
Show InChI InChI=1S/C27H35ClN4O4/c1-19(2)18-36-26-9-6-23(28)15-22(26)17-32-20(3)14-25(30-32)27(35)29-24-7-4-21(5-8-24)16-31(10-12-33)11-13-34/h4-9,14-15,19,33-34H,10-13,16-18H2,1-3H3,(H,29,35)
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n/an/a 15.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412222
PNG
(CHEMBL480002)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccccc2CO)cc1C
Show InChI InChI=1S/C23H26ClN3O3/c1-15(2)14-30-21-9-8-19(24)11-18(21)12-27-16(3)10-22(26-27)25-23(29)20-7-5-4-6-17(20)13-28/h4-11,15,28H,12-14H2,1-3H3,(H,25,26,29)
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n/an/a 25.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412233
PNG
(CHEMBL495107)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CNCCO)cc1
Show InChI InChI=1S/C25H31ClN4O3/c1-17(2)16-33-24-9-6-21(26)13-20(24)15-30-18(3)12-23(29-30)25(32)28-22-7-4-19(5-8-22)14-27-10-11-31/h4-9,12-13,17,27,31H,10-11,14-16H2,1-3H3,(H,28,32)
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n/an/a 25.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412240
PNG
(CHEMBL495294)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(cc1C)C(=O)Nc1ccc(CO)cc1
Show InChI InChI=1S/C23H26ClN3O3/c1-15(2)14-30-22-9-6-19(24)11-18(22)12-27-16(3)10-21(26-27)23(29)25-20-7-4-17(13-28)5-8-20/h4-11,15,28H,12-14H2,1-3H3,(H,25,29)
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n/an/a 31.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412223
PNG
(CHEMBL404698)
Show SMILES Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C25H22ClN3O2/c1-18-14-23(25(30)27-22-10-6-3-7-11-22)28-29(18)16-20-15-21(26)12-13-24(20)31-17-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,27,30)
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n/an/a 39.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412212
PNG
(CHEMBL492829)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1C
Show InChI InChI=1S/C28H35ClN4O2/c1-20(2)19-35-26-12-11-25(29)16-24(26)18-33-21(3)15-27(31-33)30-28(34)23-9-7-22(8-10-23)17-32-13-5-4-6-14-32/h7-12,15-16,20H,4-6,13-14,17-19H2,1-3H3,(H,30,31,34)
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n/an/a 39.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412208
PNG
(CHEMBL493254)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc3CNCCc3c2)cc1C
Show InChI InChI=1S/C25H29ClN4O2/c1-16(2)15-32-23-7-6-22(26)12-21(23)14-30-17(3)10-24(29-30)28-25(31)19-4-5-20-13-27-9-8-18(20)11-19/h4-7,10-12,16,27H,8-9,13-15H2,1-3H3,(H,28,29,31)
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n/an/a 39.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412243
PNG
(CHEMBL521988)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1C
Show InChI InChI=1S/C27H33ClN4O3/c1-19(2)18-35-25-9-8-24(28)15-23(25)17-32-20(3)14-26(30-32)29-27(33)22-6-4-21(5-7-22)16-31-10-12-34-13-11-31/h4-9,14-15,19H,10-13,16-18H2,1-3H3,(H,29,30,33)
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n/an/a 50.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412241
PNG
(CHEMBL495091)
Show SMILES CCN1CCc2ccc(cc2CC1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C28H35ClN4O2/c1-5-32-12-10-21-6-7-23(15-22(21)11-13-32)28(34)30-27-14-20(4)33(31-27)17-24-16-25(29)8-9-26(24)35-18-19(2)3/h6-9,14-16,19H,5,10-13,17-18H2,1-4H3,(H,30,31,34)
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n/an/a 50.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412210
PNG
(CHEMBL494269)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(cc2)C(C)N2CCCC2)cc1C
Show InChI InChI=1S/C28H35ClN4O2/c1-19(2)18-35-26-12-11-25(29)16-24(26)17-33-20(3)15-27(31-33)30-28(34)23-9-7-22(8-10-23)21(4)32-13-5-6-14-32/h7-12,15-16,19,21H,5-6,13-14,17-18H2,1-4H3,(H,30,31,34)
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n/an/a 50.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412211
PNG
(CHEMBL494268)
Show SMILES CC(C)CNC(C)c1ccc(cc1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C28H37ClN4O2/c1-18(2)15-30-21(6)22-7-9-23(10-8-22)28(34)31-27-13-20(5)33(32-27)16-24-14-25(29)11-12-26(24)35-17-19(3)4/h7-14,18-19,21,30H,15-17H2,1-6H3,(H,31,32,34)
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n/an/a 50.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412213
PNG
(CHEMBL481689)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CN3CCCC3)cc2)cc1C
Show InChI InChI=1S/C27H33ClN4O2/c1-19(2)18-34-25-11-10-24(28)15-23(25)17-32-20(3)14-26(30-32)29-27(33)22-8-6-21(7-9-22)16-31-12-4-5-13-31/h6-11,14-15,19H,4-5,12-13,16-18H2,1-3H3,(H,29,30,33)
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n/an/a 50.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412206
PNG
(CHEMBL495090)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc3CCNCCc3c2)cc1C
Show InChI InChI=1S/C26H31ClN4O2/c1-17(2)16-33-24-7-6-23(27)14-22(24)15-31-18(3)12-25(30-31)29-26(32)21-5-4-19-8-10-28-11-9-20(19)13-21/h4-7,12-14,17,28H,8-11,15-16H2,1-3H3,(H,29,30,32)
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n/an/a 79.4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412209
PNG
(CHEMBL494466)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(cc2)C2CCCN2)cc1C
Show InChI InChI=1S/C26H31ClN4O2/c1-17(2)16-33-24-11-10-22(27)14-21(24)15-31-18(3)13-25(30-31)29-26(32)20-8-6-19(7-9-20)23-5-4-12-28-23/h6-11,13-14,17,23,28H,4-5,12,15-16H2,1-3H3,(H,29,30,32)
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n/an/a 100n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412214
PNG
(CHEMBL481519)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc(CN(C)C)cc2)cc1C
Show InChI InChI=1S/C25H31ClN4O2/c1-17(2)16-32-23-11-10-22(26)13-21(23)15-30-18(3)12-24(28-30)27-25(31)20-8-6-19(7-9-20)14-29(4)5/h6-13,17H,14-16H2,1-5H3,(H,27,28,31)
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n/an/a 100n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412215
PNG
(CHEMBL481870)
Show SMILES CCNCc1ccc(cc1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C25H31ClN4O2/c1-5-27-14-19-6-8-20(9-7-19)25(31)28-24-12-18(4)30(29-24)15-21-13-22(26)10-11-23(21)32-16-17(2)3/h6-13,17,27H,5,14-16H2,1-4H3,(H,28,29,31)
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n/an/a 100n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412207
PNG
(CHEMBL492840)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc3CN(CCc3c2)C(C)C)cc1C
Show InChI InChI=1S/C28H35ClN4O2/c1-18(2)17-35-26-9-8-25(29)14-24(26)16-33-20(5)12-27(31-33)30-28(34)22-6-7-23-15-32(19(3)4)11-10-21(23)13-22/h6-9,12-14,18-19H,10-11,15-17H2,1-5H3,(H,30,31,34)
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n/an/a 100n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412219
PNG
(CHEMBL481137)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2cccc(CN3CCCC3)c2)cc1C
Show InChI InChI=1S/C27H33ClN4O2/c1-19(2)18-34-25-10-9-24(28)15-23(25)17-32-20(3)13-26(30-32)29-27(33)22-8-6-7-21(14-22)16-31-11-4-5-12-31/h6-10,13-15,19H,4-5,11-12,16-18H2,1-3H3,(H,29,30,33)
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n/an/a 126n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412217
PNG
(CHEMBL520950)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2cccc(CN3CCOCC3)c2)cc1C
Show InChI InChI=1S/C27H33ClN4O3/c1-19(2)18-35-25-8-7-24(28)15-23(25)17-32-20(3)13-26(30-32)29-27(33)22-6-4-5-21(14-22)16-31-9-11-34-12-10-31/h4-8,13-15,19H,9-12,16-18H2,1-3H3,(H,29,30,33)
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n/an/a 251n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412218
PNG
(CHEMBL482132)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2cccc(CN3CCCCC3)c2)cc1C
Show InChI InChI=1S/C28H35ClN4O2/c1-20(2)19-35-26-11-10-25(29)16-24(26)18-33-21(3)14-27(31-33)30-28(34)23-9-7-8-22(15-23)17-32-12-5-4-6-13-32/h7-11,14-16,20H,4-6,12-13,17-19H2,1-3H3,(H,30,31,34)
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n/an/a 501n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412221
PNG
(CHEMBL516608)
Show SMILES CCNCc1cccc(c1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C25H31ClN4O2/c1-5-27-14-19-7-6-8-20(12-19)25(31)28-24-11-18(4)30(29-24)15-21-13-22(26)9-10-23(21)32-16-17(2)3/h6-13,17,27H,5,14-16H2,1-4H3,(H,28,29,31)
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n/an/a 501n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412220
PNG
(CHEMBL480979)
Show SMILES CC(C)COc1ccc(Cl)cc1Cn1nc(NC(=O)c2cccc(CN(C)C)c2)cc1C
Show InChI InChI=1S/C25H31ClN4O2/c1-17(2)16-32-23-10-9-22(26)13-21(23)15-30-18(3)11-24(28-30)27-25(31)20-8-6-7-19(12-20)14-29(4)5/h6-13,17H,14-16H2,1-5H3,(H,27,28,31)
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n/an/a 631n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair