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Compile Data Set for Download or QSAR

Found 3777 hits Enz. Inhib. hit(s) with Target = 'G protein-coupled receptor 44' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124831
PNG
(US8759386, 28)
Show SMILES CCCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)cc1
Show InChI InChI=1S/C26H27FN4O3/c1-4-11-30-23-13-20(27)8-7-19(23)12-24(30)26(34)28-21-9-5-18(6-10-21)15-31-17(3)22(14-25(32)33)16(2)29-31/h5-10,12-13H,4,11,14-15H2,1-3H3,(H,28,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124858
PNG
(US8759386, 55)
Show SMILES CCCCn1c(cc2cc(F)ccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C27H28F2N4O3/c1-4-5-10-32-24-9-7-20(28)11-19(24)12-25(32)27(36)30-21-8-6-18(23(29)13-21)15-33-17(3)22(14-26(34)35)16(2)31-33/h6-9,11-13H,4-5,10,14-15H2,1-3H3,(H,30,36)(H,34,35)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196955
PNG
(US9206164, 19)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3cc4ccccc4cc3[nH]2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C27H26N4O2/c1-3-22-21(15-26(32)33)25(4-2)31(30-22)16-17-9-11-18(12-10-17)27-28-23-13-19-7-5-6-8-20(19)14-24(23)29-27/h5-14H,3-4,15-16H2,1-2H3,(H,28,29)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124832
PNG
(US8759386, 29)
Show SMILES CCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)cc1
Show InChI InChI=1S/C25H25FN4O3/c1-4-29-22-12-19(26)8-7-18(22)11-23(29)25(33)27-20-9-5-17(6-10-20)14-30-16(3)21(13-24(31)32)15(2)28-30/h5-12H,4,13-14H2,1-3H3,(H,27,33)(H,31,32)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124821
PNG
(US8759386, 18)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccccc4n3Cc3ccccc3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C30H28N4O3/c1-20-26(17-29(35)36)21(2)34(32-20)19-23-12-14-25(15-13-23)31-30(37)28-16-24-10-6-7-11-27(24)33(28)18-22-8-4-3-5-9-22/h3-16H,17-19H2,1-2H3,(H,31,37)(H,35,36)
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<0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124817
PNG
(US8759386, 14)
Show SMILES COc1ccc2[nH]c(C(=O)Nc3ccc(Cn4nc(C)c(CC(O)=O)c4C)cc3)c(C)c2c1
Show InChI InChI=1S/C25H26N4O4/c1-14-20-11-19(33-4)9-10-22(20)27-24(14)25(32)26-18-7-5-17(6-8-18)13-29-16(3)21(12-23(30)31)15(2)28-29/h5-11,27H,12-13H2,1-4H3,(H,26,32)(H,30,31)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124844
PNG
(US8759386, 41)
Show SMILES CCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C25H24F2N4O3/c1-4-30-22-10-18(26)7-5-16(22)9-23(30)25(34)28-19-8-6-17(21(27)11-19)13-31-15(3)20(12-24(32)33)14(2)29-31/h5-11H,4,12-13H2,1-3H3,(H,28,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124852
PNG
(US8759386, 49)
Show SMILES COc1ccc2oc(C(=O)Nc3ccc(Cn4nc(C)c(CC(O)=O)c4C)c(F)c3)c(C)c2c1
Show InChI InChI=1S/C25H24FN3O5/c1-13-19-10-18(33-4)7-8-22(19)34-24(13)25(32)27-17-6-5-16(21(26)9-17)12-29-15(3)20(11-23(30)31)14(2)28-29/h5-10H,11-12H2,1-4H3,(H,27,32)(H,30,31)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127296
PNG
(US8791272, 17.1)
Show SMILES CCc1nn(C(C)c2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C25H26F3N3O3/c1-4-21-20(14-23(32)33)22(5-2)31(30-21)15(3)16-8-12-19(13-9-16)29-24(34)17-6-10-18(11-7-17)25(26,27)28/h6-13,15H,4-5,14H2,1-3H3,(H,29,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127194
PNG
(US8791272, 3.12)
Show SMILES CCc1nn(Cc2ccc(NC(=O)OCc3ccc4ccccc4c3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C28H29N3O4/c1-3-25-24(16-27(32)33)26(4-2)31(30-25)17-19-10-13-23(14-11-19)29-28(34)35-18-20-9-12-21-7-5-6-8-22(21)15-20/h5-15H,3-4,16-18H2,1-2H3,(H,29,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127191
PNG
(US8791272, 3.9)
Show SMILES CCc1nn(Cc2ccc(NC(=O)OCc3ccc(Cl)c(Cl)c3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C24H25Cl2N3O4/c1-3-21-18(12-23(30)31)22(4-2)29(28-21)13-15-5-8-17(9-6-15)27-24(32)33-14-16-7-10-19(25)20(26)11-16/h5-11H,3-4,12-14H2,1-2H3,(H,27,32)(H,30,31)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM197024
PNG
(US9206164, 88 | US9206164, 98)
Show SMILES CCc1nn(Cc2ccc(cc2F)-c2nc3cc(ccc3[nH]2)C(C)(C)C)c(CC)c1CC(O)=O
Show InChI InChI=1S/C27H31FN4O2/c1-6-21-19(14-25(33)34)24(7-2)32(31-21)15-17-9-8-16(12-20(17)28)26-29-22-11-10-18(27(3,4)5)13-23(22)30-26/h8-13H,6-7,14-15H2,1-5H3,(H,29,30)(H,33,34)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127173
PNG
(US8791272, 2.50)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2)c(C2CC2)c1CC(O)=O
Show InChI InChI=1S/C25H24F3N3O3/c1-2-21-20(13-22(32)33)23(16-5-6-16)31(30-21)14-15-3-11-19(12-4-15)29-24(34)17-7-9-18(10-8-17)25(26,27)28/h3-4,7-12,16H,2,5-6,13-14H2,1H3,(H,29,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50397639
PNG
(CHEMBL2181751 | US8791272, 2.47)
Show SMILES CCc1c(CC(O)=O)c(nn1Cc1ccc(NC(=O)c2ccc(cc2)C(F)(F)F)cc1)C1CC1
Show InChI InChI=1S/C25H24F3N3O3/c1-2-21-20(13-22(32)33)23(16-5-6-16)30-31(21)14-15-3-11-19(12-4-15)29-24(34)17-7-9-18(10-8-17)25(26,27)28/h3-4,7-12,16H,2,5-6,13-14H2,1H3,(H,29,34)(H,32,33)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127166
PNG
(US8791272, 2.42)
Show SMILES CCCc1nn(Cc2ccc(NC(=O)c3ccc4ccccc4c3)cc2)c(C(C)C)c1CC(O)=O
Show InChI InChI=1S/C29H31N3O3/c1-4-7-26-25(17-27(33)34)28(19(2)3)32(31-26)18-20-10-14-24(15-11-20)30-29(35)23-13-12-21-8-5-6-9-22(21)16-23/h5-6,8-16,19H,4,7,17-18H2,1-3H3,(H,30,35)(H,33,34)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124845
PNG
(US8759386, 42)
Show SMILES CCCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C26H26F2N4O3/c1-4-9-31-23-11-19(27)7-5-17(23)10-24(31)26(35)29-20-8-6-18(22(28)12-20)14-32-16(3)21(13-25(33)34)15(2)30-32/h5-8,10-12H,4,9,13-14H2,1-3H3,(H,29,35)(H,33,34)
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0.100n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124813
PNG
(US8759386, 10)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccccc4[nH]3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H22N4O3/c1-14-19(12-22(28)29)15(2)27(26-14)13-16-7-9-18(10-8-16)24-23(30)21-11-17-5-3-4-6-20(17)25-21/h3-11,25H,12-13H2,1-2H3,(H,24,30)(H,28,29)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124815
PNG
(US8759386, 12)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4cc(F)ccc4[nH]3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H21FN4O3/c1-13-19(11-22(29)30)14(2)28(27-13)12-15-3-6-18(7-4-15)25-23(31)21-10-16-9-17(24)5-8-20(16)26-21/h3-10,26H,11-12H2,1-2H3,(H,25,31)(H,29,30)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124822
PNG
(US8759386, 19)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3cc4cc(Cl)ccc4o3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C25H24ClN3O4/c1-3-20-19(13-24(30)31)21(4-2)29(28-20)14-15-5-8-18(9-6-15)27-25(32)23-12-16-11-17(26)7-10-22(16)33-23/h5-12H,3-4,13-14H2,1-2H3,(H,27,32)(H,30,31)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124825
PNG
(US8759386, 22)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3cc4ccccc4n3CC)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C27H30N4O3/c1-4-22-21(16-26(32)33)23(5-2)31(29-22)17-18-11-13-20(14-12-18)28-27(34)25-15-19-9-7-8-10-24(19)30(25)6-3/h7-15H,4-6,16-17H2,1-3H3,(H,28,34)(H,32,33)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124828
PNG
(US8759386, 25)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3cc4ccc(F)cc4[nH]3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C25H25FN4O3/c1-3-20-19(13-24(31)32)23(4-2)30(29-20)14-15-5-9-18(10-6-15)27-25(33)22-11-16-7-8-17(26)12-21(16)28-22/h5-12,28H,3-4,13-14H2,1-2H3,(H,27,33)(H,31,32)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124814
PNG
(US8759386, 11)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccc(F)cc4[nH]3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H21FN4O3/c1-13-19(11-22(29)30)14(2)28(27-13)12-15-3-7-18(8-4-15)25-23(31)21-9-16-5-6-17(24)10-20(16)26-21/h3-10,26H,11-12H2,1-2H3,(H,25,31)(H,29,30)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124806
PNG
(US8759386, 3)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccccc4n3Cc3ccccc3)cc2F)c(C)c1CC(O)=O
Show InChI InChI=1S/C30H27FN4O3/c1-19-25(16-29(36)37)20(2)35(33-19)18-23-12-13-24(15-26(23)31)32-30(38)28-14-22-10-6-7-11-27(22)34(28)17-21-8-4-3-5-9-21/h3-15H,16-18H2,1-2H3,(H,32,38)(H,36,37)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50397643
PNG
(CHEMBL2181803)
Show SMILES Cc1c(CC(O)=O)c2ccc(F)cn2c1Sc1ccc(cc1F)S(C)(=O)=O
Show InChI InChI=1S/C18H15F2NO4S2/c1-10-13(8-17(22)23)15-5-3-11(19)9-21(15)18(10)26-16-6-4-12(7-14(16)20)27(2,24)25/h3-7,9H,8H2,1-2H3,(H,22,23)
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0.200n/an/an/an/an/an/an/an/a



Oxagen Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from CRTH2 expressed in HEK293 cells after 3 hrs by liquid scintillation counting


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127176
PNG
(US8791272, 2.53)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H22F3N3O3/c1-3-20-19(12-21(30)31)14(2)29(28-20)13-15-4-10-18(11-5-15)27-22(32)16-6-8-17(9-7-16)23(24,25)26/h4-11H,3,12-13H2,1-2H3,(H,27,32)(H,30,31)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127165
PNG
(US8791272, 2.41)
Show SMILES CCCc1nn(Cc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2)c(C(C)C)c1CC(O)=O
Show InChI InChI=1S/C26H28F3N3O3/c1-4-5-22-21(14-23(33)34)24(16(2)3)32(31-22)15-17-6-12-20(13-7-17)30-25(35)18-8-10-19(11-9-18)26(27,28)29/h6-13,16H,4-5,14-15H2,1-3H3,(H,30,35)(H,33,34)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127164
PNG
(US8791272, 2.40)
Show SMILES CCCc1nn(Cc2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)c(C(C)C)c1CC(O)=O
Show InChI InChI=1S/C25H27Cl2N3O3/c1-4-5-22-19(13-23(31)32)24(15(2)3)30(29-22)14-16-6-9-18(10-7-16)28-25(33)17-8-11-20(26)21(27)12-17/h6-12,15H,4-5,13-14H2,1-3H3,(H,28,33)(H,31,32)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124835
PNG
(US8759386, 32)
Show SMILES CCn1c(cc2cc(F)ccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C25H24F2N4O3/c1-4-30-22-8-6-18(26)9-17(22)10-23(30)25(34)28-19-7-5-16(21(27)11-19)13-31-15(3)20(12-24(32)33)14(2)29-31/h5-11H,4,12-13H2,1-3H3,(H,28,34)(H,32,33)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127125
PNG
(US8791272, 2.1)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C24H24F3N3O3/c1-3-20-19(13-22(31)32)21(4-2)30(29-20)14-15-5-11-18(12-6-15)28-23(33)16-7-9-17(10-8-16)24(25,26)27/h5-12H,3-4,13-14H2,1-2H3,(H,28,33)(H,31,32)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127104
PNG
(US8791272, 1.15)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3ccc(cc3)C(C)(C)C)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C25H29N3O3/c1-16-22(14-23(29)30)17(2)28(27-16)15-18-6-12-21(13-7-18)26-24(31)19-8-10-20(11-9-19)25(3,4)5/h6-13H,14-15H2,1-5H3,(H,26,31)(H,29,30)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM197004
PNG
(US9206164, 68)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3cc(ccc3[nH]2)C(C)(C)C)c(CC)c1CC(O)=O
Show InChI InChI=1S/C27H32N4O2/c1-6-21-20(15-25(32)33)24(7-2)31(30-21)16-17-8-10-18(11-9-17)26-28-22-13-12-19(27(3,4)5)14-23(22)29-26/h8-14H,6-7,15-16H2,1-5H3,(H,28,29)(H,32,33)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196956
PNG
(US9206164, 20)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(F)(F)F)c(CC)c1CC(O)=O
Show InChI InChI=1S/C24H23F3N4O2/c1-3-18-17(12-22(32)33)21(4-2)31(30-18)13-14-5-7-15(8-6-14)23-28-19-10-9-16(24(25,26)27)11-20(19)29-23/h5-11H,3-4,12-13H2,1-2H3,(H,28,29)(H,32,33)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196952
PNG
(US9206164, 16)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3cc(Cl)c(Cl)cc3[nH]2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C23H22Cl2N4O2/c1-3-18-15(9-22(30)31)21(4-2)29(28-18)12-13-5-7-14(8-6-13)23-26-19-10-16(24)17(25)11-20(19)27-23/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,26,27)(H,30,31)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124859
PNG
(US8759386, 56)
Show SMILES CCCn1c(cc2ccccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C26H27FN4O3/c1-4-11-30-23-8-6-5-7-18(23)12-24(30)26(34)28-20-10-9-19(22(27)13-20)15-31-17(3)21(14-25(32)33)16(2)29-31/h5-10,12-13H,4,11,14-15H2,1-3H3,(H,28,34)(H,32,33)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124857
PNG
(US8759386, 54)
Show SMILES CCCn1c(cc2cc(F)ccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C26H26F2N4O3/c1-4-9-31-23-8-6-19(27)10-18(23)11-24(31)26(35)29-20-7-5-17(22(28)12-20)14-32-16(3)21(13-25(33)34)15(2)30-32/h5-8,10-12H,4,9,13-14H2,1-3H3,(H,29,35)(H,33,34)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124856
PNG
(US8759386, 53)
Show SMILES CCCCn1c(cc2ccccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C27H29FN4O3/c1-4-5-12-31-24-9-7-6-8-19(24)13-25(31)27(35)29-21-11-10-20(23(28)14-21)16-32-18(3)22(15-26(33)34)17(2)30-32/h6-11,13-14H,4-5,12,15-16H2,1-3H3,(H,29,35)(H,33,34)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124839
PNG
(US8759386, 36)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccc(Cl)cc4o3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H20ClN3O4/c1-13-19(11-22(28)29)14(2)27(26-13)12-15-3-7-18(8-4-15)25-23(30)21-9-16-5-6-17(24)10-20(16)31-21/h3-10H,11-12H2,1-2H3,(H,25,30)(H,28,29)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127131
PNG
(US8791272, 2.14)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3ccc4ccccc4c3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C27H27N3O3/c1-3-24-23(16-26(31)32)25(4-2)30(29-24)17-18-9-13-22(14-10-18)28-27(33)21-12-11-19-7-5-6-8-20(19)15-21/h5-15H,3-4,16-17H2,1-2H3,(H,28,33)(H,31,32)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124834
PNG
(US8759386, 31)
Show SMILES CCn1c(cc2ccccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C25H25FN4O3/c1-4-29-22-8-6-5-7-17(22)11-23(29)25(33)27-19-10-9-18(21(26)12-19)14-30-16(3)20(13-24(31)32)15(2)28-30/h5-12H,4,13-14H2,1-3H3,(H,27,33)(H,31,32)
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0.200n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127130
PNG
(US8791272, 2.6)
Show SMILES CCc1nn(Cc2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C23H23Cl2N3O3/c1-3-20-17(12-22(29)30)21(4-2)28(27-20)13-14-5-8-16(9-6-14)26-23(31)15-7-10-18(24)19(25)11-15/h5-11H,3-4,12-13H2,1-2H3,(H,26,31)(H,29,30)
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0.25n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124838
PNG
(US8759386, 35)
Show SMILES CCc1c(oc2c(F)cc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)cc1
Show InChI InChI=1S/C25H23F2N3O4/c1-4-18-20-9-16(26)10-21(27)23(20)34-24(18)25(33)28-17-7-5-15(6-8-17)12-30-14(3)19(11-22(31)32)13(2)29-30/h5-10H,4,11-12H2,1-3H3,(H,28,33)(H,31,32)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124847
PNG
(US8759386, 44)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3oc4ccc(Cl)cc4c3C)cc2F)c(C)c1CC(O)=O
Show InChI InChI=1S/C24H21ClFN3O4/c1-12-18-8-16(25)5-7-21(18)33-23(12)24(32)27-17-6-4-15(20(26)9-17)11-29-14(3)19(10-22(30)31)13(2)28-29/h4-9H,10-11H2,1-3H3,(H,27,32)(H,30,31)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124848
PNG
(US8759386, 45)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3oc4cc(Br)ccc4c3C)cc2F)c(C)c1CC(O)=O
Show InChI InChI=1S/C24H21BrFN3O4/c1-12-18-7-5-16(25)8-21(18)33-23(12)24(32)27-17-6-4-15(20(26)9-17)11-29-14(3)19(10-22(30)31)13(2)28-29/h4-9H,10-11H2,1-3H3,(H,27,32)(H,30,31)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196943
PNG
(US9206164, 4)
Show SMILES Cc1nn(Cc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(F)(F)F)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H20F3N3O2/c1-13-19(11-22(30)31)14(2)29(28-13)12-15-3-5-16(6-4-15)20-9-17-7-8-18(23(24,25)26)10-21(17)27-20/h3-10,27H,11-12H2,1-2H3,(H,30,31)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196964
PNG
(US9206164, 28)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3cc(Br)c(Cl)cc3[nH]2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C23H22BrClN4O2/c1-3-18-15(9-22(30)31)21(4-2)29(28-18)12-13-5-7-14(8-6-13)23-26-19-10-16(24)17(25)11-20(19)27-23/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,26,27)(H,30,31)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM196981
PNG
(US9206164, 45)
Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3cc(Cl)ccc3[nH]2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C23H23ClN4O2/c1-3-18-17(12-22(29)30)21(4-2)28(27-18)13-14-5-7-15(8-6-14)23-25-19-10-9-16(24)11-20(19)26-23/h5-11H,3-4,12-13H2,1-2H3,(H,25,26)(H,29,30)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM197042
PNG
(US9206164, 106)
Show SMILES CCc1nn(Cc2ccc(cc2F)-c2nc3cc(C)c(Cl)cc3[nH]2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C24H24ClFN4O2/c1-4-19-16(10-23(31)32)22(5-2)30(29-19)12-15-7-6-14(9-18(15)26)24-27-20-8-13(3)17(25)11-21(20)28-24/h6-9,11H,4-5,10,12H2,1-3H3,(H,27,28)(H,31,32)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US9206164 (2015)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127209
PNG
(US8791272, 7.5)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3ccc4ccccc4c3)cc2C)c(C)c1CC(O)=O
Show InChI InChI=1S/C26H25N3O3/c1-16-12-23(27-26(32)21-9-8-19-6-4-5-7-20(19)13-21)11-10-22(16)15-29-18(3)24(14-25(30)31)17(2)28-29/h4-13H,14-15H2,1-3H3,(H,27,32)(H,30,31)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM127185
PNG
(US8791272, 3.3)
Show SMILES CCc1nn(Cc2ccc(NC(=O)OCc3ccccc3)cc2)c(CC)c1CC(O)=O
Show InChI InChI=1S/C24H27N3O4/c1-3-21-20(14-23(28)29)22(4-2)27(26-21)15-17-10-12-19(13-11-17)25-24(30)31-16-18-8-6-5-7-9-18/h5-13H,3-4,14-16H2,1-2H3,(H,25,30)(H,28,29)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8791272 (2014)

More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124811
PNG
(US8759386, 8)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4cc(Cl)ccc4o3)cc2)c(C)c1CC(O)=O
Show InChI InChI=1S/C23H20ClN3O4/c1-13-19(11-22(28)29)14(2)27(26-13)12-15-3-6-18(7-4-15)25-23(30)21-10-16-9-17(24)5-8-20(16)31-21/h3-10H,11-12H2,1-2H3,(H,25,30)(H,28,29)
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0.300n/an/an/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair
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