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Patent code US9670220

Compile Data Set for Download or QSAR
Found 66 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
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
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n/an/an/an/a 250n/an/an/a25



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196260
PNG
(US9670220, 227)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)c(Cl)c2)c(F)c1
Show InChI InChI=1S/C23H21Cl2FN2O4/c24-16-5-3-14(10-17(16)25)13-31-20-6-4-15(11-18(20)26)23-27-19-12-28(8-1-2-22(29)30)9-7-21(19)32-23/h3-6,10-11H,1-2,7-9,12-13H2,(H,29,30)
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n/an/an/an/a 1.00E+3n/an/an/a25



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195889
PNG
(US9670220, 33)
Show SMILES OC(=O)CCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C23H22FNO4/c24-20-4-2-1-3-17(20)15-28-19-7-5-16(6-8-19)22-13-18-14-25(12-10-23(26)27)11-9-21(18)29-22/h1-8,13H,9-12,14-15H2,(H,26,27)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195894
PNG
(US9670220, 57)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c24-18-4-1-3-16(22(18)25)14-30-17-8-6-15(7-9-17)23-26-19-13-27(11-2-5-21(28)29)12-10-20(19)31-23/h1,3-4,6-9H,2,5,10-14H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195896
PNG
(US9670220, 76)
Show SMILES CC(CC(O)=O)N1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C24H25NO4/c1-17(13-24(26)27)25-12-11-22-20(15-25)14-23(29-22)19-7-9-21(10-8-19)28-16-18-5-3-2-4-6-18/h2-10,14,17H,11-13,15-16H2,1H3,(H,26,27)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196198
PNG
(US9670220, 157)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C23H23ClN2O4/c1-15(23(27)28)12-26-11-10-21-20(13-26)25-22(30-21)17-4-8-19(9-5-17)29-14-16-2-6-18(24)7-3-16/h2-9,15H,10-14H2,1H3,(H,27,28)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196221
PNG
(US9670220, 211)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1F
Show InChI InChI=1S/C23H22ClFN2O4/c24-16-5-3-15(4-6-16)14-30-17-7-8-18(19(25)12-17)23-26-20-13-27(10-1-2-22(28)29)11-9-21(20)31-23/h3-8,12H,1-2,9-11,13-14H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196179
PNG
(US9670220, 146)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H24N2O4/c1-16(23(26)27)13-25-12-11-21-20(14-25)24-22(29-21)18-7-9-19(10-8-18)28-15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,26,27)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196180
PNG
(US9670220, 156)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C24H23F3N2O4/c1-15(23(30)31)12-29-11-10-21-20(13-29)28-22(33-21)17-4-8-19(9-5-17)32-14-16-2-6-18(7-3-16)24(25,26)27/h2-9,15H,10-14H2,1H3,(H,30,31)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196261
PNG
(US9670220, 271)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1)C(O)=O
Show InChI InChI=1S/C24H22F4N2O4/c1-14(23(31)32)11-30-9-8-21-19(12-30)29-22(34-21)16-4-7-20(18(25)10-16)33-13-15-2-5-17(6-3-15)24(26,27)28/h2-7,10,14H,8-9,11-13H2,1H3,(H,31,32)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195897
PNG
(US9670220, 77)
Show SMILES CC(CN1CCc2oc(cc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C24H24ClNO4/c1-16(24(27)28)13-26-11-10-22-19(14-26)12-23(30-22)18-4-8-21(9-5-18)29-15-17-2-6-20(25)7-3-17/h2-9,12,16H,10-11,13-15H2,1H3,(H,27,28)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196211
PNG
(US9670220, 175)
Show SMILES CC(CC(O)=O)N1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c1-14(11-21(28)29)27-10-9-20-19(12-27)26-23(31-20)15-5-7-17(8-6-15)30-13-16-3-2-4-18(24)22(16)25/h2-8,14H,9-13H2,1H3,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195892
PNG
(US9670220, 47)
Show SMILES OC(=O)CCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C22H21FN2O4/c23-18-4-2-1-3-16(18)14-28-17-7-5-15(6-8-17)22-24-19-13-25(12-10-21(26)27)11-9-20(19)29-22/h1-8H,9-14H2,(H,26,27)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195895
PNG
(US9670220, 73)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)c(F)c1
Show InChI InChI=1S/C24H23F2NO4/c25-19-5-2-1-4-17(19)15-30-22-8-7-16(12-20(22)26)23-13-18-14-27(10-3-6-24(28)29)11-9-21(18)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196174
PNG
(US9670220, 89)
Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1
Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)
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n/an/an/an/a 1.30E+3n/an/an/a25



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195899
PNG
(US9670220, 85)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1
Show InChI InChI=1S/C24H22F4N2O4/c25-18-12-16(5-8-20(18)33-14-15-3-6-17(7-4-15)24(26,27)28)23-29-19-13-30(10-1-2-22(31)32)11-9-21(19)34-23/h3-8,12H,1-2,9-11,13-14H2,(H,31,32)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195889
PNG
(US9670220, 33)
Show SMILES OC(=O)CCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C23H22FNO4/c24-20-4-2-1-3-17(20)15-28-19-7-5-16(6-8-19)22-13-18-14-25(12-10-23(26)27)11-9-21(18)29-22/h1-8,13H,9-12,14-15H2,(H,26,27)
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n/an/an/an/a 3.20E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
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n/an/an/an/a 5.00E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195892
PNG
(US9670220, 47)
Show SMILES OC(=O)CCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C22H21FN2O4/c23-18-4-2-1-3-16(18)14-28-17-7-5-15(6-8-17)22-24-19-13-25(12-10-21(26)27)11-9-20(19)29-22/h1-8H,9-14H2,(H,26,27)
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n/an/an/an/a 10n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195893
PNG
(US9670220, 53)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C23H24N2O4/c26-22(27)7-4-13-25-14-12-21-20(15-25)24-23(29-21)18-8-10-19(11-9-18)28-16-17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12-16H2,(H,26,27)
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n/an/an/an/a 13n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196267
PNG
(US9670220, 283)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1Cl
Show InChI InChI=1S/C24H23ClFNO4/c25-20-13-18(30-15-16-4-1-2-5-21(16)26)7-8-19(20)23-12-17-14-27(10-3-6-24(28)29)11-9-22(17)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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n/an/an/an/a 50n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196180
PNG
(US9670220, 156)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C24H23F3N2O4/c1-15(23(30)31)12-29-11-10-21-20(13-29)28-22(33-21)17-4-8-19(9-5-17)32-14-16-2-6-18(7-3-16)24(25,26)27/h2-9,15H,10-14H2,1H3,(H,30,31)
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n/an/an/an/a 3.20E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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n/an/an/an/a 40n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195892
PNG
(US9670220, 47)
Show SMILES OC(=O)CCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C22H21FN2O4/c23-18-4-2-1-3-16(18)14-28-17-7-5-15(6-8-17)22-24-19-13-25(12-10-21(26)27)11-9-20(19)29-22/h1-8H,9-14H2,(H,26,27)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195895
PNG
(US9670220, 73)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)c(F)c1
Show InChI InChI=1S/C24H23F2NO4/c25-19-5-2-1-4-17(19)15-30-22-8-7-16(12-20(22)26)23-13-18-14-27(10-3-6-24(28)29)11-9-21(18)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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n/an/an/an/a 6.30n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195897
PNG
(US9670220, 77)
Show SMILES CC(CN1CCc2oc(cc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C24H24ClNO4/c1-16(24(27)28)13-26-11-10-22-19(14-26)12-23(30-22)18-4-8-21(9-5-18)29-15-17-2-6-20(25)7-3-17/h2-9,12,16H,10-11,13-15H2,1H3,(H,27,28)
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n/an/an/an/a 4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195897
PNG
(US9670220, 77)
Show SMILES CC(CN1CCc2oc(cc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C24H24ClNO4/c1-16(24(27)28)13-26-11-10-22-19(14-26)12-23(30-22)18-4-8-21(9-5-18)29-15-17-2-6-20(25)7-3-17/h2-9,12,16H,10-11,13-15H2,1H3,(H,27,28)
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n/an/an/an/a 790n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195899
PNG
(US9670220, 85)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1
Show InChI InChI=1S/C24H22F4N2O4/c25-18-12-16(5-8-20(18)33-14-15-3-6-17(7-4-15)24(26,27)28)23-29-19-13-30(10-1-2-22(31)32)11-9-21(19)34-23/h3-8,12H,1-2,9-11,13-14H2,(H,31,32)
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n/an/an/an/a 2.5n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196211
PNG
(US9670220, 175)
Show SMILES CC(CC(O)=O)N1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c1-14(11-21(28)29)27-10-9-20-19(12-27)26-23(31-20)15-5-7-17(8-6-15)30-13-16-3-2-4-18(24)22(16)25/h2-8,14H,9-13H2,1H3,(H,28,29)
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n/an/an/an/a 1.60E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196263
PNG
(US9670220, 277)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(F)c(F)c2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-9.88,-4.22,;-10.65,-2.89,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C24H22F2N2O4/c25-19-6-1-14(9-20(19)26)13-31-18-4-2-15(3-5-18)23-27-21-12-28(8-7-22(21)32-23)17-10-16(11-17)24(29)30/h1-6,9,16-17H,7-8,10-13H2,(H,29,30)/t16-,17?
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n/an/an/an/a 3.20n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195889
PNG
(US9670220, 33)
Show SMILES OC(=O)CCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C23H22FNO4/c24-20-4-2-1-3-17(20)15-28-19-7-5-16(6-8-19)22-13-18-14-25(12-10-23(26)27)11-9-21(18)29-22/h1-8,13H,9-12,14-15H2,(H,26,27)
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n/an/an/an/a 16n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM195893
PNG
(US9670220, 53)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C23H24N2O4/c26-22(27)7-4-13-25-14-12-21-20(15-25)24-23(29-21)18-8-10-19(11-9-18)28-16-17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12-16H2,(H,26,27)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195894
PNG
(US9670220, 57)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c24-18-4-1-3-16(22(18)25)14-30-17-8-6-15(7-9-17)23-26-19-13-27(11-2-5-21(28)29)12-10-20(19)31-23/h1,3-4,6-9H,2,5,10-14H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196260
PNG
(US9670220, 227)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)c(Cl)c2)c(F)c1
Show InChI InChI=1S/C23H21Cl2FN2O4/c24-16-5-3-14(10-17(16)25)13-31-20-6-4-15(11-18(20)26)23-27-19-12-28(8-1-2-22(29)30)9-7-21(19)32-23/h3-6,10-11H,1-2,7-9,12-13H2,(H,29,30)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195894
PNG
(US9670220, 57)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c24-18-4-1-3-16(22(18)25)14-30-17-8-6-15(7-9-17)23-26-19-13-27(11-2-5-21(28)29)12-10-20(19)31-23/h1,3-4,6-9H,2,5,10-14H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195895
PNG
(US9670220, 73)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)c(F)c1
Show InChI InChI=1S/C24H23F2NO4/c25-19-5-2-1-4-17(19)15-30-22-8-7-16(12-20(22)26)23-13-18-14-27(10-3-6-24(28)29)11-9-21(18)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM195896
PNG
(US9670220, 76)
Show SMILES CC(CC(O)=O)N1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C24H25NO4/c1-17(13-24(26)27)25-12-11-22-20(15-25)14-23(29-22)19-7-9-21(10-8-19)28-16-18-5-3-2-4-6-18/h2-10,14,17H,11-13,15-16H2,1H3,(H,26,27)
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n/an/an/an/a 7.90n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196198
PNG
(US9670220, 157)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C23H23ClN2O4/c1-15(23(27)28)12-26-11-10-21-20(13-26)25-22(30-21)17-4-8-19(9-5-17)29-14-16-2-6-18(24)7-3-16/h2-9,15H,10-14H2,1H3,(H,27,28)
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n/an/an/an/a 7.90n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196221
PNG
(US9670220, 211)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1F
Show InChI InChI=1S/C23H22ClFN2O4/c24-16-5-3-15(4-6-16)14-30-17-7-8-18(19(25)12-17)23-26-20-13-27(10-1-2-22(28)29)11-9-21(20)31-23/h3-8,12H,1-2,9-11,13-14H2,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195899
PNG
(US9670220, 85)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1
Show InChI InChI=1S/C24H22F4N2O4/c25-18-12-16(5-8-20(18)33-14-15-3-6-17(7-4-15)24(26,27)28)23-29-19-13-30(10-1-2-22(31)32)11-9-21(19)34-23/h3-8,12H,1-2,9-11,13-14H2,(H,31,32)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196174
PNG
(US9670220, 89)
Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1
Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)
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n/an/an/an/a 6.30n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196179
PNG
(US9670220, 146)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H24N2O4/c1-16(23(26)27)13-25-12-11-21-20(14-25)24-22(29-21)18-7-9-19(10-8-18)28-15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,26,27)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196211
PNG
(US9670220, 175)
Show SMILES CC(CC(O)=O)N1CCc2oc(nc2C1)-c1ccc(OCc2cccc(F)c2F)cc1
Show InChI InChI=1S/C23H22F2N2O4/c1-14(11-21(28)29)27-10-9-20-19(12-27)26-23(31-20)15-5-7-17(8-6-15)30-13-16-3-2-4-18(24)22(16)25/h2-8,14H,9-13H2,1H3,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196267
PNG
(US9670220, 283)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1Cl
Show InChI InChI=1S/C24H23ClFNO4/c25-20-13-18(30-15-16-4-1-2-5-21(16)26)7-8-19(20)23-12-17-14-27(10-3-6-24(28)29)11-9-22(17)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196286
PNG
(US9670220, 306)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196286
PNG
(US9670220, 306)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196286
PNG
(US9670220, 306)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196265
PNG
(US9670220, 278 | US9670220, 307)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1 |r,wD:3.2,(11.82,-4.87,;10.31,-5.19,;9.84,-6.66,;9.28,-4.05,;7.75,-3.89,;7.28,-5.35,;8.81,-5.51,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-12.96,-4.23,;-14.5,-4.23,;-12.19,-2.89,;-13.73,-5.56,;-9.88,-4.22,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C25H23F3N2O5/c26-25(27,28)35-20-5-1-15(2-6-20)14-33-19-7-3-16(4-8-19)23-29-21-13-30(10-9-22(21)34-23)18-11-17(12-18)24(31)32/h1-8,17-18H,9-14H2,(H,31,32)/t17-,18?
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195893
PNG
(US9670220, 53)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C23H24N2O4/c26-22(27)7-4-13-25-14-12-21-20(15-25)24-23(29-21)18-8-10-19(11-9-18)28-16-17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12-16H2,(H,26,27)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM195896
PNG
(US9670220, 76)
Show SMILES CC(CC(O)=O)N1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C24H25NO4/c1-17(13-24(26)27)25-12-11-22-20(15-25)14-23(29-22)19-7-9-21(10-8-19)28-16-18-5-3-2-4-6-18/h2-10,14,17H,11-13,15-16H2,1H3,(H,26,27)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196174
PNG
(US9670220, 89)
Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1
Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196179
PNG
(US9670220, 146)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H24N2O4/c1-16(23(26)27)13-25-12-11-21-20(14-25)24-22(29-21)18-7-9-19(10-8-18)28-15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,26,27)
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n/an/an/an/a 16n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196180
PNG
(US9670220, 156)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C24H23F3N2O4/c1-15(23(30)31)12-29-11-10-21-20(13-29)28-22(33-21)17-4-8-19(9-5-17)32-14-16-2-6-18(7-3-16)24(25,26)27/h2-9,15H,10-14H2,1H3,(H,30,31)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196260
PNG
(US9670220, 227)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)c(Cl)c2)c(F)c1
Show InChI InChI=1S/C23H21Cl2FN2O4/c24-16-5-3-14(10-17(16)25)13-31-20-6-4-15(11-18(20)26)23-27-19-12-28(8-1-2-22(29)30)9-7-21(19)32-23/h3-6,10-11H,1-2,7-9,12-13H2,(H,29,30)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196261
PNG
(US9670220, 271)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1)C(O)=O
Show InChI InChI=1S/C24H22F4N2O4/c1-14(23(31)32)11-30-9-8-21-19(12-30)29-22(34-21)16-4-7-20(18(25)10-16)33-13-15-2-5-17(6-3-15)24(26,27)28/h2-7,10,14H,8-9,11-13H2,1H3,(H,31,32)
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n/an/an/an/a 10n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM196263
PNG
(US9670220, 277)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(F)c(F)c2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-9.88,-4.22,;-10.65,-2.89,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C24H22F2N2O4/c25-19-6-1-14(9-20(19)26)13-31-18-4-2-15(3-5-18)23-27-21-12-28(8-7-22(21)32-23)17-10-16(11-17)24(29)30/h1-6,9,16-17H,7-8,10-13H2,(H,29,30)/t16-,17?
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n/an/an/an/a 6.30E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-human-S1P1-Acqorin assay was bought from Euroscreen Fast, Brussels (Euroscreen, Technical dossier, Human S1P1 (Edg1) receptor, DNA clone a...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196198
PNG
(US9670220, 157)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C23H23ClN2O4/c1-15(23(27)28)12-26-11-10-21-20(13-26)25-22(30-21)17-4-8-19(9-5-17)29-14-16-2-6-18(24)7-3-16/h2-9,15H,10-14H2,1H3,(H,27,28)
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n/an/an/an/a 5.00E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196221
PNG
(US9670220, 211)
Show SMILES OC(=O)CCCN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(Cl)cc2)cc1F
Show InChI InChI=1S/C23H22ClFN2O4/c24-16-5-3-15(4-6-16)14-30-17-7-8-18(19(25)12-17)23-26-20-13-27(10-1-2-22(28)29)11-9-21(20)31-23/h3-8,12H,1-2,9-11,13-14H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196261
PNG
(US9670220, 271)
Show SMILES CC(CN1CCc2oc(nc2C1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(F)c1)C(O)=O
Show InChI InChI=1S/C24H22F4N2O4/c1-14(23(31)32)11-30-9-8-21-19(12-30)29-22(34-21)16-4-7-20(18(25)10-16)33-13-15-2-5-17(6-3-15)24(26,27)28/h2-7,10,14H,8-9,11-13H2,1H3,(H,31,32)
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n/an/an/an/a 4.00E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))		BDBM196263
PNG
(US9670220, 277)
Show SMILES OC(=O)[C@H]1CC(C1)N1CCc2oc(nc2C1)-c1ccc(OCc2ccc(F)c(F)c2)cc1 |r,wU:3.2,(10.37,-1.61,;9.12,-2.52,;7.72,-1.89,;9.28,-4.05,;8.81,-5.51,;7.28,-5.35,;7.75,-3.89,;5.94,-6.12,;5.94,-7.66,;4.61,-8.43,;3.28,-7.66,;1.81,-8.14,;.91,-6.89,;1.81,-5.65,;3.28,-6.12,;4.61,-5.35,;-.64,-6.89,;-1.41,-8.23,;-2.94,-8.23,;-3.72,-6.89,;-5.26,-6.89,;-6.03,-5.56,;-7.57,-5.56,;-8.34,-6.89,;-9.88,-6.89,;-10.65,-5.56,;-12.19,-5.56,;-9.88,-4.22,;-10.65,-2.89,;-8.34,-4.23,;-2.94,-5.56,;-1.41,-5.56,)|
Show InChI InChI=1S/C24H22F2N2O4/c25-19-6-1-14(9-20(19)26)13-31-18-4-2-15(3-5-18)23-27-21-12-28(8-7-22(21)32-23)17-10-16(11-17)24(29)30/h1-6,9,16-17H,7-8,10-13H2,(H,29,30)/t16-,17?
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n/an/an/an/a>1.00E+4n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM196267
PNG
(US9670220, 283)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1Cl
Show InChI InChI=1S/C24H23ClFNO4/c25-20-13-18(30-15-16-4-1-2-5-21(16)26)7-8-19(20)23-12-17-14-27(10-3-6-24(28)29)11-9-22(17)31-23/h1-2,4-5,7-8,12-13H,3,6,9-11,14-15H2,(H,28,29)
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Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...

US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%