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Patent code US9617250

Compile Data Set for Download or QSAR
Found 26 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 3


(Homo sapiens (human))
BDBM50080575
PNG
(CHEMBL3126602 | US9617250, Example 2)
Show SMILES CCCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C24H30N4O5/c1-4-6-19-11-17(7-8-25-19)24-27-23(28-33-24)18-9-15(3)22(16(5-2)10-18)32-14-20(30)12-26-21(31)13-29/h7-11,20,29-30H,4-6,12-14H2,1-3H3,(H,26,31)/t20-/m0/s1
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n/an/an/an/a 1.12E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080560
PNG
(CHEMBL3126607 | US9617250, Example 7)
Show SMILES CCC(CC)c1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C26H34N4O5/c1-5-17(6-2)22-12-19(8-9-27-22)26-29-25(30-35-26)20-10-16(4)24(18(7-3)11-20)34-15-21(32)13-28-23(33)14-31/h8-12,17,21,31-32H,5-7,13-15H2,1-4H3,(H,28,33)/t21-/m0/s1
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n/an/an/an/a 1.34E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM317450
PNG
(US9617250, Example 57 of D1)
Show SMILES CCc1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C24H30N4O5/c1-5-16-9-17(7-14(3)22(16)32-13-20(30)11-25-21(31)12-29)23-27-24(33-28-23)18-8-15(4)26-19(6-2)10-18/h7-10,20,29-30H,5-6,11-13H2,1-4H3,(H,25,31)/t20-/m0/s1
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n/an/an/an/a 1.54E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM317451
PNG
(US9617250, Example 101 of D1)
Show SMILES CCCc1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C25H32N4O5/c1-5-7-20-11-19(9-16(4)27-20)25-28-24(29-34-25)18-8-15(3)23(17(6-2)10-18)33-14-21(31)12-26-22(32)13-30/h8-11,21,30-31H,5-7,12-14H2,1-4H3,(H,26,32)/t21-/m0/s1
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n/an/an/an/a 0.400n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM317451
PNG
(US9617250, Example 101 of D1)
Show SMILES CCCc1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C25H32N4O5/c1-5-7-20-11-19(9-16(4)27-20)25-28-24(29-34-25)18-8-15(3)23(17(6-2)10-18)33-14-21(31)12-26-22(32)13-30/h8-11,21,30-31H,5-7,12-14H2,1-4H3,(H,26,32)/t21-/m0/s1
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n/an/an/an/a 310n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080574
PNG
(CHEMBL3126603 | US9617250, Example 3)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(c1)C(C)C
Show InChI InChI=1S/C24H30N4O5/c1-5-16-9-18(8-15(4)22(16)32-13-19(30)11-26-21(31)12-29)23-27-24(33-28-23)17-6-7-25-20(10-17)14(2)3/h6-10,14,19,29-30H,5,11-13H2,1-4H3,(H,26,31)/t19-/m0/s1
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n/an/an/an/a 0.300n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080573
PNG
(CHEMBL3126604 | US9617250, Example 4)
Show SMILES CCCCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C25H32N4O5/c1-4-6-7-20-12-18(8-9-26-20)25-28-24(29-34-25)19-10-16(3)23(17(5-2)11-19)33-15-21(31)13-27-22(32)14-30/h8-12,21,30-31H,4-7,13-15H2,1-3H3,(H,27,32)/t21-/m0/s1
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n/an/an/an/a 700n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM317450
PNG
(US9617250, Example 57 of D1)
Show SMILES CCc1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C24H30N4O5/c1-5-16-9-17(7-14(3)22(16)32-13-20(30)11-25-21(31)12-29)23-27-24(33-28-23)18-8-15(4)26-19(6-2)10-18/h7-10,20,29-30H,5-6,11-13H2,1-4H3,(H,25,31)/t20-/m0/s1
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n/an/an/an/a 0.300n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM317452
PNG
(US9617250, S-entiomer of Example 22 of D1)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(C)nc(CC(C)C)c1
Show InChI InChI=1S/C26H34N4O5/c1-6-18-10-19(8-16(4)24(18)34-14-22(32)12-27-23(33)13-31)25-29-26(35-30-25)20-9-17(5)28-21(11-20)7-15(2)3/h8-11,15,22,31-32H,6-7,12-14H2,1-5H3,(H,27,33)/t22-/m0/s1
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n/an/an/an/a 33n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080558
PNG
(CHEMBL3126601 | US9617250, Example 1)
Show SMILES CCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C23H28N4O5/c1-4-15-9-17(8-14(3)21(15)31-13-19(29)11-25-20(30)12-28)22-26-23(32-27-22)16-6-7-24-18(5-2)10-16/h6-10,19,28-29H,4-5,11-13H2,1-3H3,(H,25,30)/t19-/m0/s1
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n/an/an/an/a 2.10n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080570
PNG
(CHEMBL3126605 | US9617250, Example 5)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(CC(C)C)c1
Show InChI InChI=1S/C25H32N4O5/c1-5-17-10-19(9-16(4)23(17)33-14-21(31)12-27-22(32)13-30)24-28-25(34-29-24)18-6-7-26-20(11-18)8-15(2)3/h6-7,9-11,15,21,30-31H,5,8,12-14H2,1-4H3,(H,27,32)/t21-/m0/s1
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ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080559
PNG
(CHEMBL3126433 | US9617250, Example 8)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(c1)C1CCCC1
Show InChI InChI=1S/C26H32N4O5/c1-3-17-11-20(10-16(2)24(17)34-15-21(32)13-28-23(33)14-31)25-29-26(35-30-25)19-8-9-27-22(12-19)18-6-4-5-7-18/h8-12,18,21,31-32H,3-7,13-15H2,1-2H3,(H,28,33)/t21-/m0/s1
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n/an/an/an/a 0.100n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080560
PNG
(CHEMBL3126607 | US9617250, Example 7)
Show SMILES CCC(CC)c1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C26H34N4O5/c1-5-17(6-2)22-12-19(8-9-27-22)26-29-25(30-35-26)20-10-16(4)24(18(7-3)11-20)34-15-21(32)13-28-23(33)14-31/h8-12,17,21,31-32H,5-7,13-15H2,1-4H3,(H,28,33)/t21-/m0/s1
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n/an/an/an/a 0.100n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080575
PNG
(CHEMBL3126602 | US9617250, Example 2)
Show SMILES CCCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C24H30N4O5/c1-4-6-19-11-17(7-8-25-19)24-27-23(28-33-24)18-9-15(3)22(16(5-2)10-18)32-14-20(30)12-26-21(31)13-29/h7-11,20,29-30H,4-6,12-14H2,1-3H3,(H,26,31)/t20-/m0/s1
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n/an/an/an/a 0.700n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM317452
PNG
(US9617250, S-entiomer of Example 22 of D1)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(C)nc(CC(C)C)c1
Show InChI InChI=1S/C26H34N4O5/c1-6-18-10-19(8-16(4)24(18)34-14-22(32)12-27-23(33)13-31)25-29-26(35-30-25)20-9-17(5)28-21(11-20)7-15(2)3/h8-11,15,22,31-32H,6-7,12-14H2,1-5H3,(H,27,33)/t22-/m0/s1
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n/an/an/an/a 0.100n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM317453
PNG
(BDBM50165434 | US9617250, Example 1 Example 204 of...)
Show SMILES CCC(CC)c1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C27H36N4O5/c1-6-18(7-2)23-12-21(10-17(5)29-23)27-30-26(31-36-27)20-9-16(4)25(19(8-3)11-20)35-15-22(33)13-28-24(34)14-32/h9-12,18,22,32-33H,6-8,13-15H2,1-5H3,(H,28,34)/t22-/m0/s1
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n/an/an/an/a 0.200n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM317453
PNG
(BDBM50165434 | US9617250, Example 1 Example 204 of...)
Show SMILES CCC(CC)c1cc(cc(C)n1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C27H36N4O5/c1-6-18(7-2)23-12-21(10-17(5)29-23)27-30-26(31-36-27)20-9-16(4)25(19(8-3)11-20)35-15-22(33)13-28-24(34)14-32/h9-12,18,22,32-33H,6-8,13-15H2,1-5H3,(H,28,34)/t22-/m0/s1
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n/an/an/an/a 44n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080558
PNG
(CHEMBL3126601 | US9617250, Example 1)
Show SMILES CCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C23H28N4O5/c1-4-15-9-17(8-14(3)21(15)31-13-19(29)11-25-20(30)12-28)22-26-23(32-27-22)16-6-7-24-18(5-2)10-16/h6-10,19,28-29H,4-5,11-13H2,1-3H3,(H,25,30)/t19-/m0/s1
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n/an/an/an/a 9.95E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080573
PNG
(CHEMBL3126604 | US9617250, Example 4)
Show SMILES CCCCc1cc(ccn1)-c1nc(no1)-c1cc(C)c(OC[C@@H](O)CNC(=O)CO)c(CC)c1
Show InChI InChI=1S/C25H32N4O5/c1-4-6-7-20-12-18(8-9-26-20)25-28-24(29-34-25)19-10-16(3)23(17(5-2)11-19)33-15-21(31)13-27-22(32)14-30/h8-12,21,30-31H,4-7,13-15H2,1-3H3,(H,27,32)/t21-/m0/s1
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n/an/an/an/a 1.80n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080570
PNG
(CHEMBL3126605 | US9617250, Example 5)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(CC(C)C)c1
Show InChI InChI=1S/C25H32N4O5/c1-5-17-10-19(9-16(4)23(17)33-14-21(31)12-27-22(32)13-30)24-28-25(34-29-24)18-6-7-26-20(11-18)8-15(2)3/h6-7,9-11,15,21,30-31H,5,8,12-14H2,1-4H3,(H,27,32)/t21-/m0/s1
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n/an/an/an/a 757n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50080563
PNG
(CHEMBL3422425 | US9617250, Example 6)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(CCC(C)C)c1
Show InChI InChI=1S/C26H34N4O5/c1-5-18-11-20(10-17(4)24(18)34-15-22(32)13-28-23(33)14-31)25-29-26(35-30-25)19-8-9-27-21(12-19)7-6-16(2)3/h8-12,16,22,31-32H,5-7,13-15H2,1-4H3,(H,28,33)/t22-/m0/s1
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n/an/an/an/a 5.10n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080559
PNG
(CHEMBL3126433 | US9617250, Example 8)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(c1)C1CCCC1
Show InChI InChI=1S/C26H32N4O5/c1-3-17-11-20(10-16(2)24(17)34-15-21(32)13-28-23(33)14-31)25-29-26(35-30-25)19-8-9-27-22(12-19)18-6-4-5-7-18/h8-12,18,21,31-32H,3-7,13-15H2,1-2H3,(H,28,33)/t21-/m0/s1
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n/an/an/an/a 736n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM317454
PNG
(US9617250, Example 233 of D1)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(C)nc(c1)C1CCCC1
Show InChI InChI=1S/C27H34N4O5/c1-4-18-11-20(9-16(2)25(18)35-15-22(33)13-28-24(34)14-32)26-30-27(36-31-26)21-10-17(3)29-23(12-21)19-7-5-6-8-19/h9-12,19,22,32-33H,4-8,13-15H2,1-3H3,(H,28,34)/t22-/m0/s1
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n/an/an/an/a 0.200n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM317454
PNG
(US9617250, Example 233 of D1)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(C)nc(c1)C1CCCC1
Show InChI InChI=1S/C27H34N4O5/c1-4-18-11-20(9-16(2)25(18)35-15-22(33)13-28-24(34)14-32)26-30-27(36-31-26)21-10-17(3)29-23(12-21)19-7-5-6-8-19/h9-12,19,22,32-33H,4-8,13-15H2,1-3H3,(H,28,34)/t22-/m0/s1
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n/an/an/an/a 47n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080574
PNG
(CHEMBL3126603 | US9617250, Example 3)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(c1)C(C)C
Show InChI InChI=1S/C24H30N4O5/c1-5-16-9-18(8-15(4)22(16)32-13-19(30)11-26-21(31)12-29)23-27-24(33-28-23)17-6-7-25-20(10-17)14(2)3/h6-10,14,19,29-30H,5,11-13H2,1-4H3,(H,26,31)/t19-/m0/s1
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n/an/an/an/a 3.94E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (human))
BDBM50080563
PNG
(CHEMBL3422425 | US9617250, Example 6)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1ccnc(CCC(C)C)c1
Show InChI InChI=1S/C26H34N4O5/c1-5-18-11-20(10-17(4)24(18)34-15-22(32)13-28-23(33)14-31)25-29-26(35-30-25)19-8-9-27-21(12-19)7-6-16(2)3/h8-12,16,22,31-32H,5-7,13-15H2,1-4H3,(H,28,33)/t22-/m0/s1
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n/an/an/an/a 2.60E+3n/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
GTPγS binding assays are performed in 96 well microtiter plates (Nunc, 442587) in a final volume of 200 μl, using membrane preparations of ...


US Patent US9617250 (2017)

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