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Compile Data Set for Download or QSAR

Found 116 hits with Last Name = 'zanuy' and Initial = 'm'   
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 D2 receptor 2


(Homo sapiens (Human))		BDBM50034956
PNG
(CHEMBL3338150)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)n2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-4-5-14)13-15-10-16(23(24,25)26)6-7-18(15)19-11-17(12-20(30)31)29-9-3-8-27-21(19)29/h3,6-11,14H,2,4-5,12-13H2,1H3,(H,30,31)
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n/an/a 1.40n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034956
PNG
(CHEMBL3338150)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)n2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-4-5-14)13-15-10-16(23(24,25)26)6-7-18(15)19-11-17(12-20(30)31)29-9-3-8-27-21(19)29/h3,6-11,14H,2,4-5,12-13H2,1H3,(H,30,31)
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n/an/a 1.40n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human eosinophil assessed as inhibition of PGD2-induced cell shape change

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035031
PNG
(CHEMBL3343129)
Show SMILES COCCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C25H26F3N3O4/c1-15-3-7-20-17(12-22(32)33)14-31(23(20)29-15)21-8-6-19(25(26,27)28)11-18(21)13-30(9-10-35-2)24(34)16-4-5-16/h3,6-8,11,14,16H,4-5,9-10,12-13H2,1-2H3,(H,32,33)
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n/an/a 4n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035030
PNG
(CHEMBL3343128)
Show SMILES Cc1ccc2c(CC(O)=O)cn(-c3ccc(cc3CN(CCOc3ccccc3)C(=O)C3CC3)C(F)(F)F)c2n1
Show InChI InChI=1S/C30H28F3N3O4/c1-19-7-11-25-21(16-27(37)38)18-36(28(25)34-19)26-12-10-23(30(31,32)33)15-22(26)17-35(29(39)20-8-9-20)13-14-40-24-5-3-2-4-6-24/h2-7,10-12,15,18,20H,8-9,13-14,16-17H2,1H3,(H,37,38)
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n/an/a 4n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035019
PNG
(CHEMBL3343118)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)c2ccc(C)nn12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)13-17-10-18(24(25,26)27)7-8-19(17)21-11-16(12-22(31)32)20-9-4-14(2)28-30(20)21/h4,7-11,15H,3,5-6,12-13H2,1-2H3,(H,31,32)
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n/an/a 4.20n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034960
PNG
(CHEMBL3342994)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2cccc(F)c12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H21F4N3O3/c1-2-29(22(33)13-6-7-13)11-14-10-15(23(25,26)27)8-9-16(14)21-20-17(24)4-3-5-18(20)30(28-21)12-19(31)32/h3-5,8-10,13H,2,6-7,11-12H2,1H3,(H,31,32)
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n/an/a 4.30n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034979
PNG
(CHEMBL3343106)
Show SMILES CCN(Cc1cc(F)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C23H24FN3O3/c1-3-26(23(30)15-5-6-15)12-17-10-18(24)7-9-20(17)27-13-16(11-21(28)29)19-8-4-14(2)25-22(19)27/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,28,29)
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n/an/a 4.70n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035026
PNG
(CHEMBL3343124)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)NCc1ccccc1
Show InChI InChI=1S/C28H27F3N4O3/c1-3-34(27(38)32-15-19-7-5-4-6-8-19)16-21-13-22(28(29,30)31)10-12-24(21)35-17-20(14-25(36)37)23-11-9-18(2)33-26(23)35/h4-13,17H,3,14-16H2,1-2H3,(H,32,38)(H,36,37)
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n/an/a 4.70n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034980
PNG
(CHEMBL3338153)
Show SMILES CCN(Cc1ccccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C23H25N3O3/c1-3-25(23(29)16-9-10-16)13-17-6-4-5-7-20(17)26-14-18(12-21(27)28)19-11-8-15(2)24-22(19)26/h4-8,11,14,16H,3,9-10,12-13H2,1-2H3,(H,27,28)
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n/an/a 5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035023
PNG
(CHEMBL3343121)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)COC
Show InChI InChI=1S/C23H24F3N3O4/c1-4-28(20(30)13-33-3)11-16-9-17(23(24,25)26)6-8-19(16)29-12-15(10-21(31)32)18-7-5-14(2)27-22(18)29/h5-9,12H,4,10-11,13H2,1-3H3,(H,31,32)
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n/an/a 5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035026
PNG
(CHEMBL3343124)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)NCc1ccccc1
Show InChI InChI=1S/C28H27F3N4O3/c1-3-34(27(38)32-15-19-7-5-4-6-8-19)16-21-13-22(28(29,30)31)10-12-24(21)35-17-20(14-25(36)37)23-11-9-18(2)33-26(23)35/h4-13,17H,3,14-16H2,1-2H3,(H,32,38)(H,36,37)
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n/an/a 5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034981
PNG
(CHEMBL3343107)
Show SMILES CCN(Cc1cc(Cl)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C23H24ClN3O3/c1-3-26(23(30)15-5-6-15)12-17-10-18(24)7-9-20(17)27-13-16(11-21(28)29)19-8-4-14(2)25-22(19)27/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,28,29)
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n/an/a 5.20n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034983
PNG
(CHEMBL3343109)
Show SMILES CCN(Cc1cc(OC(F)(F)F)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O4/c1-3-29(23(33)15-5-6-15)12-17-10-18(34-24(25,26)27)7-9-20(17)30-13-16(11-21(31)32)19-8-4-14(2)28-22(19)30/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,31,32)
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n/an/a 5.80n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034982
PNG
(CHEMBL3343108)
Show SMILES CCN(Cc1cc(C)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C24H27N3O3/c1-4-26(24(30)17-7-8-17)13-19-11-15(2)5-10-21(19)27-14-18(12-22(28)29)20-9-6-16(3)25-23(20)27/h5-6,9-11,14,17H,4,7-8,12-13H2,1-3H3,(H,28,29)
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n/an/a 5.90n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035024
PNG
(CHEMBL3343122)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)Cc1ccccc1
Show InChI InChI=1S/C28H26F3N3O3/c1-3-33(25(35)13-19-7-5-4-6-8-19)16-21-14-22(28(29,30)31)10-12-24(21)34-17-20(15-26(36)37)23-11-9-18(2)32-27(23)34/h4-12,14,17H,3,13,15-16H2,1-2H3,(H,36,37)
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n/an/a 6n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034959
PNG
(CHEMBL3342993)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2cccc(Cl)c12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H21ClF3N3O3/c1-2-29(22(33)13-6-7-13)11-14-10-15(23(25,26)27)8-9-16(14)21-20-17(24)4-3-5-18(20)30(28-21)12-19(31)32/h3-5,8-10,13H,2,6-7,11-12H2,1H3,(H,31,32)
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n/an/a 6.30n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034979
PNG
(CHEMBL3343106)
Show SMILES CCN(Cc1cc(F)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C23H24FN3O3/c1-3-26(23(30)15-5-6-15)12-17-10-18(24)7-9-20(17)27-13-16(11-21(28)29)19-8-4-14(2)25-22(19)27/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,28,29)
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n/an/a 6.40n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034983
PNG
(CHEMBL3343109)
Show SMILES CCN(Cc1cc(OC(F)(F)F)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O4/c1-3-29(23(33)15-5-6-15)12-17-10-18(34-24(25,26)27)7-9-20(17)30-13-16(11-21(31)32)19-8-4-14(2)28-22(19)30/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,31,32)
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n/an/a 6.70n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034995
PNG
(CHEMBL3343117)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)n2ccc(C)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-4-5-15)13-16-10-17(24(25,26)27)6-7-19(16)20-11-18(12-21(31)32)30-9-8-14(2)28-22(20)30/h6-11,15H,3-5,12-13H2,1-2H3,(H,31,32)
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n/an/a 7n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035022
PNG
(CHEMBL3343120)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)CC1CC1
Show InChI InChI=1S/C25H26F3N3O3/c1-3-30(22(32)10-16-5-6-16)13-18-11-19(25(26,27)28)7-9-21(18)31-14-17(12-23(33)34)20-8-4-15(2)29-24(20)31/h4,7-9,11,14,16H,3,5-6,10,12-13H2,1-2H3,(H,33,34)
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n/an/a 7n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035019
PNG
(CHEMBL3343118)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)c2ccc(C)nn12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)13-17-10-18(24(25,26)27)7-8-19(17)21-11-16(12-22(31)32)20-9-4-14(2)28-30(20)21/h4,7-11,15H,3,5-6,12-13H2,1-2H3,(H,31,32)
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n/an/a 7.30n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034994
PNG
(CHEMBL3343116)
Show SMILES CCN(Cc1ccccc1-n1cc(CC(O)=O)c2ccc(cc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H23F3N2O3/c1-2-28(23(32)15-7-8-15)13-16-5-3-4-6-20(16)29-14-17(11-22(30)31)19-10-9-18(12-21(19)29)24(25,26)27/h3-6,9-10,12,14-15H,2,7-8,11,13H2,1H3,(H,30,31)
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n/an/a 7.70n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034972
PNG
(CHEMBL3343004)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)12-17-10-18(24(25,26)27)7-9-20(17)30-13-16(11-21(31)32)19-8-4-14(2)28-22(19)30/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,31,32)
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n/an/a 7.80n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034951
PNG
(CHEMBL3338147)
Show SMILES CCN(Cc1cc(ccc1-c1cn(CC(O)=O)c2ccncc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-3-4-14)11-15-9-16(23(24,25)26)5-6-17(15)19-12-29(13-21(30)31)20-7-8-27-10-18(19)20/h5-10,12,14H,2-4,11,13H2,1H3,(H,30,31)
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n/an/a 8n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human eosinophil assessed as inhibition of PGD2-induced cell shape change

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034975
PNG
(CHEMBL3343007)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(nc12)C(F)F)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H22F5N3O3/c1-2-31(23(35)13-3-4-13)11-15-9-16(24(27,28)29)5-8-19(15)32-12-14(10-20(33)34)17-6-7-18(21(25)26)30-22(17)32/h5-9,12-13,21H,2-4,10-11H2,1H3,(H,33,34)
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n/an/a 8n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035021
PNG
(CHEMBL3343119)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CCC1
Show InChI InChI=1S/C25H26F3N3O3/c1-3-30(24(34)16-5-4-6-16)13-18-11-19(25(26,27)28)8-10-21(18)31-14-17(12-22(32)33)20-9-7-15(2)29-23(20)31/h7-11,14,16H,3-6,12-13H2,1-2H3,(H,32,33)
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n/an/a 8.5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034954
PNG
(CHEMBL3338149)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-5-6-14)12-16-10-17(23(24,25)26)7-8-19(16)29-13-15(11-20(30)31)18-4-3-9-27-21(18)29/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,30,31)
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n/an/a 9n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding at 1 t...

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035023
PNG
(CHEMBL3343121)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)COC
Show InChI InChI=1S/C23H24F3N3O4/c1-4-28(20(30)13-33-3)11-16-9-17(23(24,25)26)6-8-19(16)29-12-15(10-21(31)32)18-7-5-14(2)27-22(18)29/h5-9,12H,4,10-11,13H2,1-3H3,(H,31,32)
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n/an/a 9n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034954
PNG
(CHEMBL3338149)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-5-6-14)12-16-10-17(23(24,25)26)7-8-19(16)29-13-15(11-20(30)31)18-4-3-9-27-21(18)29/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,30,31)
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n/an/a 9n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034967
PNG
(CHEMBL3342999)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(C)cc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)12-16-11-17(24(25,26)27)7-8-18(16)22-19-10-14(2)4-9-20(19)30(28-22)13-21(31)32/h4,7-11,15H,3,5-6,12-13H2,1-2H3,(H,31,32)
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n/an/a 9n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034980
PNG
(CHEMBL3338153)
Show SMILES CCN(Cc1ccccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C23H25N3O3/c1-3-25(23(29)16-9-10-16)13-17-6-4-5-7-20(17)26-14-18(12-21(27)28)19-11-8-15(2)24-22(19)26/h4-8,11,14,16H,3,9-10,12-13H2,1-2H3,(H,27,28)
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n/an/a 9.5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035020
PNG
(CHEMBL3338271)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(C)=O
Show InChI InChI=1S/C22H22F3N3O3/c1-4-27(14(3)29)11-16-9-17(22(23,24)25)6-8-19(16)28-12-15(10-20(30)31)18-7-5-13(2)26-21(18)28/h5-9,12H,4,10-11H2,1-3H3,(H,30,31)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035021
PNG
(CHEMBL3343119)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CCC1
Show InChI InChI=1S/C25H26F3N3O3/c1-3-30(24(34)16-5-4-6-16)13-18-11-19(25(26,27)28)8-10-21(18)31-14-17(12-22(32)33)20-9-7-15(2)29-23(20)31/h7-11,14,16H,3-6,12-13H2,1-2H3,(H,32,33)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034987
PNG
(CHEMBL3343113)
Show SMILES CCN(Cc1cc(ccc1-c1cn(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)11-16-10-17(24(25,26)27)7-8-18(16)19-12-30(13-21(31)32)20-9-4-14(2)28-22(19)20/h4,7-10,12,15H,3,5-6,11,13H2,1-2H3,(H,31,32)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034970
PNG
(CHEMBL3343002)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(F)c(Cl)c12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H20ClF4N3O3/c1-2-30(22(34)12-3-4-12)10-13-9-14(23(26,27)28)5-6-15(13)21-19-17(8-7-16(25)20(19)24)31(29-21)11-18(32)33/h5-9,12H,2-4,10-11H2,1H3,(H,32,33)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034972
PNG
(CHEMBL3343004)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)12-17-10-18(24(25,26)27)7-9-20(17)30-13-16(11-21(31)32)19-8-4-14(2)28-22(19)30/h4,7-10,13,15H,3,5-6,11-12H2,1-2H3,(H,31,32)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034973
PNG
(CHEMBL3343005)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(CC)nc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C25H26F3N3O3/c1-3-19-8-9-20-16(12-22(32)33)14-31(23(20)29-19)21-10-7-18(25(26,27)28)11-17(21)13-30(4-2)24(34)15-5-6-15/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,32,33)
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n/an/a 10n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50035029
PNG
(CHEMBL3343127)
Show SMILES Cc1ccc2c(CC(O)=O)cn(-c3ccc(cc3CN(CC3CC3)C(=O)C3CC3)C(F)(F)F)c2n1
Show InChI InChI=1S/C26H26F3N3O3/c1-15-2-8-21-18(11-23(33)34)14-32(24(21)30-15)22-9-7-20(26(27,28)29)10-19(22)13-31(12-16-3-4-16)25(35)17-5-6-17/h2,7-10,14,16-17H,3-6,11-13H2,1H3,(H,33,34)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034975
PNG
(CHEMBL3343007)
Show SMILES CCN(Cc1cc(ccc1-n1cc(CC(O)=O)c2ccc(nc12)C(F)F)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H22F5N3O3/c1-2-31(23(35)13-3-4-13)11-15-9-16(24(27,28)29)5-8-19(15)32-12-14(10-20(33)34)17-6-7-18(21(25)26)30-22(17)32/h5-9,12-13,21H,2-4,10-11H2,1H3,(H,33,34)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034994
PNG
(CHEMBL3343116)
Show SMILES CCN(Cc1ccccc1-n1cc(CC(O)=O)c2ccc(cc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H23F3N2O3/c1-2-28(23(32)15-7-8-15)13-16-5-3-4-6-20(16)29-14-17(11-22(30)31)19-10-9-18(12-21(19)29)24(25,26)27/h3-6,9-10,12,14-15H,2,7-8,11,13H2,1H3,(H,30,31)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034985
PNG
(CHEMBL3343111)
Show SMILES CCN(Cc1cc(F)ccc1-c1cn(CC(O)=O)c2ccccc12)C(=O)C1CC1
Show InChI InChI=1S/C23H23FN2O3/c1-2-25(23(29)15-7-8-15)12-16-11-17(24)9-10-18(16)20-13-26(14-22(27)28)21-6-4-3-5-19(20)21/h3-6,9-11,13,15H,2,7-8,12,14H2,1H3,(H,27,28)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034985
PNG
(CHEMBL3343111)
Show SMILES CCN(Cc1cc(F)ccc1-c1cn(CC(O)=O)c2ccccc12)C(=O)C1CC1
Show InChI InChI=1S/C23H23FN2O3/c1-2-25(23(29)15-7-8-15)12-16-11-17(24)9-10-18(16)20-13-26(14-22(27)28)21-6-4-3-5-19(20)21/h3-6,9-11,13,15H,2,7-8,12,14H2,1H3,(H,27,28)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034978
PNG
(CHEMBL3343105)
Show SMILES CCN(Cc1cc(F)ccc1-n1cc(CC(O)=O)c2cccnc12)C(=O)C1CC1
Show InChI InChI=1S/C22H22FN3O3/c1-2-25(22(29)14-5-6-14)12-16-10-17(23)7-8-19(16)26-13-15(11-20(27)28)18-4-3-9-24-21(18)26/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,27,28)
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n/an/a 11n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034956
PNG
(CHEMBL3338150)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)n2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-4-5-14)13-15-10-16(23(24,25)26)6-7-18(15)19-11-17(12-20(30)31)29-9-3-8-27-21(19)29/h3,6-11,14H,2,4-5,12-13H2,1H3,(H,30,31)
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n/an/a 13n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034982
PNG
(CHEMBL3343108)
Show SMILES CCN(Cc1cc(C)ccc1-n1cc(CC(O)=O)c2ccc(C)nc12)C(=O)C1CC1
Show InChI InChI=1S/C24H27N3O3/c1-4-26(24(30)17-7-8-17)13-19-11-15(2)5-10-21(19)27-14-18(12-22(28)29)20-9-6-16(3)25-23(20)27/h5-6,9-11,14,17H,4,7-8,12-13H2,1-3H3,(H,28,29)
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n/an/a 13n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034956
PNG
(CHEMBL3338150)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)n2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-4-5-14)13-15-10-16(23(24,25)26)6-7-18(15)19-11-17(12-20(30)31)29-9-3-8-27-21(19)29/h3,6-11,14H,2,4-5,12-13H2,1H3,(H,30,31)
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n/an/a 13n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding at 1 t...

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034967
PNG
(CHEMBL3342999)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(C)cc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H24F3N3O3/c1-3-29(23(33)15-5-6-15)12-16-11-17(24(25,26)27)7-8-18(16)22-19-10-14(2)4-9-20(19)30(28-22)13-21(31)32/h4,7-11,15H,3,5-6,12-13H2,1-2H3,(H,31,32)
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n/an/a 13n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50397641
PNG
(CHEMBL2181754)
Show SMILES CCN(Cc1cc(ccc1-c1cc(CC(O)=O)ccc1OC)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H24F3NO4/c1-3-27(22(30)15-5-6-15)13-16-12-17(23(24,25)26)7-8-18(16)19-10-14(11-21(28)29)4-9-20(19)31-2/h4,7-10,12,15H,3,5-6,11,13H2,1-2H3,(H,28,29)
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n/an/a 13n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human eosinophil assessed as inhibition of PGD2-induced cell shape change

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034948
PNG
(CHEMBL3338146)
Show SMILES CCN(Cc1cc(ccc1-c1cn(CC(O)=O)c2cccnc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H22F3N3O3/c1-2-28(22(32)14-5-6-14)11-15-10-16(23(24,25)26)7-8-17(15)18-12-29(13-20(30)31)19-4-3-9-27-21(18)19/h3-4,7-10,12,14H,2,5-6,11,13H2,1H3,(H,30,31)
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n/an/a 14n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human eosinophil assessed as inhibition of PGD2-induced cell shape change

Bioorg Med Chem Lett 24: 5118-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.005
BindingDB Entry DOI: 10.7270/Q2H70HFQ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM50034986
PNG
(CHEMBL3343112)
Show SMILES CCN(Cc1cc(F)ccc1-c1cn(CC(O)=O)c2ccc(cc12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C24H22F4N2O3/c1-2-29(23(33)14-3-4-14)11-15-9-17(25)6-7-18(15)20-12-30(13-22(31)32)21-8-5-16(10-19(20)21)24(26,27)28/h5-10,12,14H,2-4,11,13H2,1H3,(H,31,32)
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n/an/a 14n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...

Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
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