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Patent code US9725442

Compile Data Set for Download or QSAR

Found 422 hits of Enzyme Inhibition Constant Data   
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))
BDBM330435
PNG
(US9725442, Compound I-49)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccc(F)cc12)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClFN3O4S/c1-12-10-24(30(28,29)15-5-2-13(21)3-6-15)11-19(12)25-18-8-14(22)4-7-16(18)17(23-25)9-20(26)27/h2-8,12,19H,9-11H2,1H3,(H,26,27)/t12-,19+/m1/s1
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0.590n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330452
PNG
(US9725442, Compound I-117)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccc(F)cc12)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C21H22FN3O4S/c1-13-3-6-16(7-4-13)30(28,29)24-11-14(2)20(12-24)25-19-9-15(22)5-8-17(19)18(23-25)10-21(26)27/h3-9,14,20H,10-12H2,1-2H3,(H,26,27)/t14-,20+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330430
PNG
(US9725442, Compound I-135 | US9725442, Compound I-...)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClN3O5S/c1-14(2)32-17-5-7-18(8-6-17)33(30,31)26-12-15(3)22(13-26)27-21-10-16(24)4-9-19(21)20(25-27)11-23(28)29/h4-10,14-15,22H,11-13H2,1-3H3,(H,28,29)/t15-,22+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330433
PNG
(US9725442, Compound I-29 | US9725442, Compound I-3...)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C23H26FN3O5S/c1-14(2)32-17-5-7-18(8-6-17)33(30,31)26-12-15(3)22(13-26)27-21-10-16(24)4-9-19(21)20(25-27)11-23(28)29/h4-10,14-15,22H,11-13H2,1-3H3,(H,28,29)/t15-,22+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330453
PNG
(US9725442, Compound I-122)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccc(F)cc12)S(=O)(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C20H19ClFN3O4S/c1-12-10-24(30(28,29)15-4-2-3-13(21)7-15)11-19(12)25-18-8-14(22)5-6-16(18)17(23-25)9-20(26)27/h2-8,12,19H,9-11H2,1H3,(H,26,27)/t12-,19+/m1/s1
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2.5n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330446
PNG
(US9725442, Compound I-85)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@H](n2nc(CC(O)=O)c3ccc(F)cc23)[C@@](C)(F)C1
Show InChI InChI=1S/C23H25F2N3O5S/c1-14(2)33-16-5-7-17(8-6-16)34(31,32)27-12-21(23(3,25)13-27)28-20-10-15(24)4-9-18(20)19(26-28)11-22(29)30/h4-10,14,21H,11-13H2,1-3H3,(H,29,30)/t21-,23-/m0/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330439
PNG
(US9725442, Compound I-62 | US9725442, Compound I-6...)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(C)cc12
Show InChI InChI=1S/C24H29N3O5S/c1-15(2)32-18-6-8-19(9-7-18)33(30,31)26-13-17(4)23(14-26)27-22-11-16(3)5-10-20(22)21(25-27)12-24(28)29/h5-11,15,17,23H,12-14H2,1-4H3,(H,28,29)/t17-,23+/m1/s1
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3.10n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330461
PNG
(US9725442, Compound I-145)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2cccnc12
Show InChI InChI=1S/C22H26N4O5S/c1-14(2)31-16-6-8-17(9-7-16)32(29,30)25-12-15(3)20(13-25)26-22-18(5-4-10-23-22)19(24-26)11-21(27)28/h4-10,14-15,20H,11-13H2,1-3H3,(H,27,28)/t15-,20+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330460
PNG
(US9725442, Compound I-144)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1cc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C24H27FN2O5S/c1-15(2)32-19-5-7-20(8-6-19)33(30,31)26-12-16(3)23(14-26)27-13-17(10-24(28)29)21-9-4-18(25)11-22(21)27/h4-9,11,13,15-16,23H,10,12,14H2,1-3H3,(H,28,29)/t16-,23+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330437
PNG
(US9725442, Compound I-123 | US9725442, Compound I-...)
Show SMILES CC(C)Oc1ccc(cn1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C22H25FN4O5S/c1-13(2)32-21-7-5-16(10-24-21)33(30,31)26-11-14(3)20(12-26)27-19-8-15(23)4-6-17(19)18(25-27)9-22(28)29/h4-8,10,13-14,20H,9,11-12H2,1-3H3,(H,28,29)/t14-,20+/m1/s1
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3.80n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330437
PNG
(US9725442, Compound I-123 | US9725442, Compound I-...)
Show SMILES CC(C)Oc1ccc(cn1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C22H25FN4O5S/c1-13(2)32-21-7-5-16(10-24-21)33(30,31)26-11-14(3)20(12-26)27-19-8-15(23)4-6-17(19)18(25-27)9-22(28)29/h4-8,10,13-14,20H,9,11-12H2,1-3H3,(H,28,29)/t14-,20+/m1/s1
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4.30n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330478
PNG
(US9725442, Compound I-239)
Show SMILES CC(C)C1CC1S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C20H26FN3O4S/c1-11(2)15-7-19(15)29(27,28)23-9-12(3)18(10-23)24-17-6-13(21)4-5-14(17)16(22-24)8-20(25)26/h4-6,11-12,15,18-19H,7-10H2,1-3H3,(H,25,26)/t12-,15?,18+,19?/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330455
PNG
(US9725442, Compound I-130)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(cc12)C(F)(F)F
Show InChI InChI=1S/C24H26F3N3O5S/c1-14(2)35-17-5-7-18(8-6-17)36(33,34)29-12-15(3)22(13-29)30-21-10-16(24(25,26)27)4-9-19(21)20(28-30)11-23(31)32/h4-10,14-15,22H,11-13H2,1-3H3,(H,31,32)/t15-,22+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330463
PNG
(US9725442, Compound I-149)
Show SMILES CC(C)Oc1ccc(nc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C22H25FN4O5S/c1-13(2)32-16-5-7-21(24-10-16)33(30,31)26-11-14(3)20(12-26)27-19-8-15(23)4-6-17(19)18(25-27)9-22(28)29/h4-8,10,13-14,20H,9,11-12H2,1-3H3,(H,28,29)/t14-,20+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330436
PNG
(US9725442, Compound I-52)
Show SMILES CC(C)Oc1ccc(c(F)c1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C23H25F2N3O5S/c1-13(2)33-16-5-7-22(18(25)9-16)34(31,32)27-11-14(3)21(12-27)28-20-8-15(24)4-6-17(20)19(26-28)10-23(29)30/h4-9,13-14,21H,10-12H2,1-3H3,(H,29,30)/t14-,21+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330462
PNG
(US9725442, Compound I-148)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1cc(CC(O)=O)c2cccnc12
Show InChI InChI=1S/C23H27N3O5S/c1-15(2)31-18-6-8-19(9-7-18)32(29,30)25-12-16(3)21(14-25)26-13-17(11-22(27)28)20-5-4-10-24-23(20)26/h4-10,13,15-16,21H,11-12,14H2,1-3H3,(H,27,28)/t16-,21+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330423
PNG
(US9725442, Compound I-9)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@H]1CO)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C23H26FN3O6S/c1-14(2)33-18-4-6-19(7-5-18)34(31,32)26-12-16(10-17(26)13-28)27-22-9-15(24)3-8-20(22)21(25-27)11-23(29)30/h3-9,14,16-17,28H,10-13H2,1-2H3,(H,29,30)/t16-,17+/m1/s1
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6.20n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330456
PNG
(US9725442, Compound I-131)
Show SMILES CC(C)Oc1ccc(cn1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(cc12)C(F)(F)F
Show InChI InChI=1S/C23H25F3N4O5S/c1-13(2)35-21-7-5-16(10-27-21)36(33,34)29-11-14(3)20(12-29)30-19-8-15(23(24,25)26)4-6-17(19)18(28-30)9-22(31)32/h4-8,10,13-14,20H,9,11-12H2,1-3H3,(H,31,32)/t14-,20+/m1/s1
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7.40n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330483
PNG
(US9725442, Compound I-280)
Show SMILES CCOc1ccc(c(CCCO)c1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C25H31N3O6S/c1-3-34-19-10-11-24(18(13-19)7-6-12-29)35(32,33)27-15-17(2)23(16-27)28-22-9-5-4-8-20(22)21(26-28)14-25(30)31/h4-5,8-11,13,17,23,29H,3,6-7,12,14-16H2,1-2H3,(H,30,31)/t17-,23+/m1/s1
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7.80n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330476
PNG
(US9725442, Compound I-220)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(cc12)C1=CCCCC1
Show InChI InChI=1S/C28H33N3O5S/c1-3-36-22-10-12-23(13-11-22)37(34,35)30-17-19(2)27(18-30)31-26-15-21(20-7-5-4-6-8-20)9-14-24(26)25(29-31)16-28(32)33/h7,9-15,19,27H,3-6,8,16-18H2,1-2H3,(H,32,33)/t19-,27+/m1/s1
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8.10n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330424
PNG
(US9725442, Compound I-10)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@H]1C)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C23H26FN3O5S/c1-14(2)32-18-5-7-19(8-6-18)33(30,31)26-13-17(10-15(26)3)27-22-11-16(24)4-9-20(22)21(25-27)12-23(28)29/h4-9,11,14-15,17H,10,12-13H2,1-3H3,(H,28,29)/t15-,17-/m1/s1
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8.20n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330484
PNG
(US9725442, Compound I-282)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1cc(CC(O)=O)c2ccc(cc12)-c1ncco1
Show InChI InChI=1S/C26H27N3O6S/c1-3-34-20-5-7-21(8-6-20)36(32,33)28-14-17(2)24(16-28)29-15-19(13-25(30)31)22-9-4-18(12-23(22)29)26-27-10-11-35-26/h4-12,15,17,24H,3,13-14,16H2,1-2H3,(H,30,31)/t17-,24+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330428
PNG
(US9725442, Compound I-21)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@@H]1Cn1cccn1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C26H28FN5O5S/c1-17(2)37-21-5-7-22(8-6-21)38(35,36)31-16-20(13-19(31)15-30-11-3-10-28-30)32-25-12-18(27)4-9-23(25)24(29-32)14-26(33)34/h3-12,17,19-20H,13-16H2,1-2H3,(H,33,34)/t19-,20-/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330473
PNG
(US9725442, Compound I-210)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1CC[C@H]([C@@H]1C)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C23H26FN3O5S/c1-14(2)32-17-5-7-18(8-6-17)33(30,31)26-11-10-21(15(26)3)27-22-12-16(24)4-9-19(22)20(25-27)13-23(28)29/h4-9,12,14-15,21H,10-11,13H2,1-3H3,(H,28,29)/t15-,21+/m0/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330459
PNG
(US9725442, Compound I-142)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccc(Cl)cc12)S(=O)(=O)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C21H19ClF3N3O5S/c1-12-10-27(34(31,32)15-5-3-14(4-6-15)33-21(23,24)25)11-19(12)28-18-8-13(22)2-7-16(18)17(26-28)9-20(29)30/h2-8,12,19H,9-11H2,1H3,(H,29,30)/t12-,19+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330470
PNG
(US9725442, Compound I-173)
Show SMILES CCOc1ccc(cn1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(cc12)C#N
Show InChI InChI=1S/C22H23N5O5S/c1-3-32-21-7-5-16(11-24-21)33(30,31)26-12-14(2)20(13-26)27-19-8-15(10-23)4-6-17(19)18(25-27)9-22(28)29/h4-8,11,14,20H,3,9,12-13H2,1-2H3,(H,28,29)/t14-,20+/m1/s1
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SHIONOGI & CO., LTD.

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Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330469
PNG
(US9725442, Compound I-166)
Show SMILES CCOc1ncc(s1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C19H21FN4O5S2/c1-3-29-19-21-8-18(30-19)31(27,28)23-9-11(2)16(10-23)24-15-6-12(20)4-5-13(15)14(22-24)7-17(25)26/h4-6,8,11,16H,3,7,9-10H2,1-2H3,(H,25,26)/t11-,16+/m1/s1
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12n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330449
PNG
(US9725442, Compound I-164 | US9725442, Compound I-...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C22H25N3O5S/c1-3-30-16-8-10-17(11-9-16)31(28,29)24-13-15(2)21(14-24)25-20-7-5-4-6-18(20)19(23-25)12-22(26)27/h4-11,15,21H,3,12-14H2,1-2H3,(H,26,27)/t15-,21+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330472
PNG
(US9725442, Compound I-177)
Show SMILES CCOc1ccc(s1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C20H23N3O5S2/c1-3-28-19-8-9-20(29-19)30(26,27)22-11-13(2)17(12-22)23-16-7-5-4-6-14(16)15(21-23)10-18(24)25/h4-9,13,17H,3,10-12H2,1-2H3,(H,24,25)/t13-,17+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330479
PNG
(US9725442, Compound I-247)
Show SMILES CCOc1ccc(nc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C21H24N4O5S/c1-3-30-15-8-9-20(22-11-15)31(28,29)24-12-14(2)19(13-24)25-18-7-5-4-6-16(18)17(23-25)10-21(26)27/h4-9,11,14,19H,3,10,12-13H2,1-2H3,(H,26,27)/t14-,19+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330450
PNG
(US9725442, Compound I-104)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@]1(C)C#N)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C24H25FN4O5S/c1-15(2)34-18-5-7-19(8-6-18)35(32,33)28-13-17(12-24(28,3)14-26)29-22-10-16(25)4-9-20(22)21(27-29)11-23(30)31/h4-10,15,17H,11-13H2,1-3H3,(H,30,31)/t17-,24-/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330449
PNG
(US9725442, Compound I-164 | US9725442, Compound I-...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C22H25N3O5S/c1-3-30-16-8-10-17(11-9-16)31(28,29)24-13-15(2)21(14-24)25-20-7-5-4-6-18(20)19(23-25)12-22(26)27/h4-11,15,21H,3,12-14H2,1-2H3,(H,26,27)/t15-,21+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330434
PNG
(US9725442, Compound I-47)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@H]([C@H](C1)n1nc(CC(O)=O)c2ccc(F)cc12)N1CCCC1
Show InChI InChI=1S/C26H31FN4O5S/c1-17(2)36-19-6-8-20(9-7-19)37(34,35)30-15-24(29-11-3-4-12-29)25(16-30)31-23-13-18(27)5-10-21(23)22(28-31)14-26(32)33/h5-10,13,17,24-25H,3-4,11-12,14-16H2,1-2H3,(H,32,33)/t24-,25+/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330451
PNG
(US9725442, Compound I-113)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccc(F)cc12)S(=O)(=O)c1ccc(cc1)C1CC1
Show InChI InChI=1S/C23H24FN3O4S/c1-14-12-26(32(30,31)18-7-4-16(5-8-18)15-2-3-15)13-22(14)27-21-10-17(24)6-9-19(21)20(25-27)11-23(28)29/h4-10,14-15,22H,2-3,11-13H2,1H3,(H,28,29)/t14-,22+/m1/s1
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17n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330482
PNG
(US9725442, Compound I-260)
Show SMILES CCOc1ccc(c(CCCNC(C)=O)c1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C27H34N4O6S/c1-4-37-21-11-12-26(20(14-21)8-7-13-28-19(3)32)38(35,36)30-16-18(2)25(17-30)31-24-10-6-5-9-22(24)23(29-31)15-27(33)34/h5-6,9-12,14,18,25H,4,7-8,13,15-17H2,1-3H3,(H,28,32)(H,33,34)/t18-,25+/m1/s1
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21n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330474
PNG
(US9725442, Compound I-215)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccccc12)S(=O)(=O)c1ccc2occc2c1
Show InChI InChI=1S/C22H21N3O5S/c1-14-12-24(31(28,29)16-6-7-21-15(10-16)8-9-30-21)13-20(14)25-19-5-3-2-4-17(19)18(23-25)11-22(26)27/h2-10,14,20H,11-13H2,1H3,(H,26,27)/t14-,20+/m1/s1
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22n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330438
PNG
(US9725442, Compound I-59)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2cccc(F)c12
Show InChI InChI=1S/C23H26FN3O5S/c1-14(2)32-16-7-9-17(10-8-16)33(30,31)26-12-15(3)21(13-26)27-23-18(5-4-6-19(23)24)20(25-27)11-22(28)29/h4-10,14-15,21H,11-13H2,1-3H3,(H,28,29)/t15-,21+/m1/s1
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23n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330489
PNG
(US9725442, Compound I-325)
Show SMILES CCOc1ccc(c(N)c1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C22H26N4O5S/c1-3-31-15-8-9-21(17(23)10-15)32(29,30)25-12-14(2)20(13-25)26-19-7-5-4-6-16(19)18(24-26)11-22(27)28/h4-10,14,20H,3,11-13,23H2,1-2H3,(H,27,28)/t14-,20+/m1/s1
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28n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330492
PNG
(US9725442, Compound I-360)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@@H]1c1ccccc1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C28H28FN3O5S/c1-18(2)37-22-9-11-23(12-10-22)38(35,36)31-17-21(15-26(31)19-6-4-3-5-7-19)32-27-14-20(29)8-13-24(27)25(30-32)16-28(33)34/h3-14,18,21,26H,15-17H2,1-2H3,(H,33,34)/t21-,26-/m1/s1
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SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330458
PNG
(US9725442, Compound I-139)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(=O)NC#N)c2ccc(F)cc12
Show InChI InChI=1S/C24H26FN5O4S/c1-15(2)34-18-5-7-19(8-6-18)35(32,33)29-12-16(3)23(13-29)30-22-10-17(25)4-9-20(22)21(28-30)11-24(31)27-14-26/h4-10,15-16,23H,11-13H2,1-3H3,(H,27,31)/t16-,23+/m1/s1
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32n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330447
PNG
(US9725442, Compound I-96)
Show SMILES CCOc1ccc(cn1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C21H24N4O5S/c1-3-30-20-9-8-15(11-22-20)31(28,29)24-12-14(2)19(13-24)25-18-7-5-4-6-16(18)17(23-25)10-21(26)27/h4-9,11,14,19H,3,10,12-13H2,1-2H3,(H,26,27)/t14-,19+/m1/s1
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37n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330486
PNG
(US9725442, Compound I-288)
Show SMILES C[C@@H]1CN(C[C@@H]1n1c(C)c(CC(O)=O)c2ccccc12)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C23H26N2O4S/c1-15-8-10-18(11-9-15)30(28,29)24-13-16(2)22(14-24)25-17(3)20(12-23(26)27)19-6-4-5-7-21(19)25/h4-11,16,22H,12-14H2,1-3H3,(H,26,27)/t16-,22+/m1/s1
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40n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330442
PNG
(US9725442, Compound I-77)
Show SMILES C[C@H]1C[C@H](CCN1S(=O)(=O)c1ccc(F)cc1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C21H21F2N3O4S/c1-13-10-16(8-9-25(13)31(29,30)17-5-2-14(22)3-6-17)26-20-11-15(23)4-7-18(20)19(24-26)12-21(27)28/h2-7,11,13,16H,8-10,12H2,1H3,(H,27,28)/t13-,16-/m0/s1
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48n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330471
PNG
(US9725442, Compound I-174)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2cc3OCOc3cc12
Show InChI InChI=1S/C24H27N3O7S/c1-14(2)34-16-4-6-17(7-5-16)35(30,31)26-11-15(3)21(12-26)27-20-10-23-22(32-13-33-23)8-18(20)19(25-27)9-24(28)29/h4-8,10,14-15,21H,9,11-13H2,1-3H3,(H,28,29)/t15-,21+/m1/s1
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50n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330485
PNG
(US9725442, Compound I-284)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(C(C)C(O)=O)c2ccccc12
Show InChI InChI=1S/C23H27N3O5S/c1-4-31-17-9-11-18(12-10-17)32(29,30)25-13-15(2)21(14-25)26-20-8-6-5-7-19(20)22(24-26)16(3)23(27)28/h5-12,15-16,21H,4,13-14H2,1-3H3,(H,27,28)/t15-,16?,21+/m1/s1
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55n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330465
PNG
(US9725442, Compound I-152)
Show SMILES C[C@@H]1CN(C[C@@H]1n1nc(CC(O)=O)c2ccccc12)S(=O)(=O)c1cc2ccccc2s1
Show InChI InChI=1S/C22H21N3O4S2/c1-14-12-24(31(28,29)22-10-15-6-2-5-9-20(15)30-22)13-19(14)25-18-8-4-3-7-16(18)17(23-25)11-21(26)27/h2-10,14,19H,11-13H2,1H3,(H,26,27)/t14-,19+/m1/s1
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56n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330425
PNG
(US9725442, Compound I-15)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C[C@H]1C)n1nc(CC(O)=O)c2cc(Cl)ccc12
Show InChI InChI=1S/C23H26ClN3O5S/c1-14(2)32-18-5-7-19(8-6-18)33(30,31)26-13-17(10-15(26)3)27-22-9-4-16(24)11-20(22)21(25-27)12-23(28)29/h4-9,11,14-15,17H,10,12-13H2,1-3H3,(H,28,29)/t15-,17-/m1/s1
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56n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330427
PNG
(US9725442, Compound I-19)
Show SMILES CO\N=C\[C@H]1C[C@H](CN1S(=O)(=O)c1ccc(OC(C)C)cc1)n1nc(CC(O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C24H27FN4O6S/c1-15(2)35-19-5-7-20(8-6-19)36(32,33)28-14-18(11-17(28)13-26-34-3)29-23-10-16(25)4-9-21(23)22(27-29)12-24(30)31/h4-10,13,15,17-18H,11-12,14H2,1-3H3,(H,30,31)/b26-13+/t17-,18-/m1/s1
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62n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330466
PNG
(US9725442, Compound I-153)
Show SMILES CC1Cc2cc(ccc2O1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C23H25N3O5S/c1-14-12-25(32(29,30)17-7-8-22-16(10-17)9-15(2)31-22)13-21(14)26-20-6-4-3-5-18(20)19(24-26)11-23(27)28/h3-8,10,14-15,21H,9,11-13H2,1-2H3,(H,27,28)/t14-,15?,21+/m1/s1
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65n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM330457
PNG
(US9725442, Compound I-138)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)N1C[C@@H](C)[C@H](C1)n1nc(CC(=O)NS(C)(=O)=O)c2ccc(F)cc12
Show InChI InChI=1S/C24H29FN4O6S2/c1-15(2)35-18-6-8-19(9-7-18)37(33,34)28-13-16(3)23(14-28)29-22-11-17(25)5-10-20(22)21(26-29)12-24(30)27-36(4,31)32/h5-11,15-16,23H,12-14H2,1-4H3,(H,27,30)/t16-,23+/m1/s1
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65n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
Cell membrane was prepared from CRTH2-expressing K562 cell. The cell membrane (20 μg/well) was mixed with reaction buffer (50 mM Tris/HCl, pH 7....


US Patent US9725442 (2017)

More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%