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Patent code US9920038

Compile Data Set for Download or QSAR
Found 62 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
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376840
PNG
(US9920038, 1)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1S/C22H27N5O3/c1-15-20(22(2,3)29)25-19(30-15)14-16-8-6-7-13-26(16)21(28)17-9-4-5-10-18(17)27-23-11-12-24-27/h4-5,9-12,16,29H,6-8,13-14H2,1-3H3/t16-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376842
PNG
((R)-(2-cyclopropylphenyl)(2- ((4-(2-hydroxypropan-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CC2)nc1C(C)(C)O
Show InChI InChI=1/C23H30N2O3/c1-15-21(23(2,3)27)24-20(28-15)14-17-8-6-7-13-25(17)22(26)19-10-5-4-9-18(19)16-11-12-16/h4-5,9-10,16-17,27H,6-8,11-14H2,1-3H3/t17-/s2
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n/an/a 17n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376840
PNG
(US9920038, 1)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1S/C22H27N5O3/c1-15-20(22(2,3)29)25-19(30-15)14-16-8-6-7-13-26(16)21(28)17-9-4-5-10-18(17)27-23-11-12-24-27/h4-5,9-12,16,29H,6-8,13-14H2,1-3H3/t16-/m1/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376844
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2OCC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F3N3O4/c1-13-17(20(2,3)29)26-16(31-13)11-14-7-4-5-10-27(14)19(28)15-8-6-9-25-18(15)30-12-21(22,23)24/h6,8-9,14,29H,4-5,7,10-12H2,1-3H3/t14-/s2
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n/an/a 19n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376841
PNG
(US9920038, 2)
Show SMILES CCOc1ncccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1S/C21H29N3O4/c1-5-27-19-16(10-8-11-22-19)20(25)24-12-7-6-9-15(24)13-17-23-18(14(2)28-17)21(3,4)26/h8,10-11,15,26H,5-7,9,12-13H2,1-4H3/t15-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376852
PNG
((R)-(2-(1H-pyrazol-1- yl)pyridin-3-yl)(2-((4-(2- h...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C22H27N5O3/c1-15-19(22(2,3)29)25-18(30-15)14-16-8-4-5-12-26(16)21(28)17-9-6-10-23-20(17)27-13-7-11-24-27/h6-7,9-11,13,16,29H,4-5,8,12,14H2,1-3H3/t16-/s2
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n/an/a 24n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376843
PNG
((R)-(4-fluoro-2-(2H-1,2,3- triazol-2-yl)phenyl)(2-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccc(F)cc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C22H26FN5O3/c1-14-20(22(2,3)30)26-19(31-14)13-16-6-4-5-11-27(16)21(29)17-8-7-15(23)12-18(17)28-24-9-10-25-28/h7-10,12,16,30H,4-6,11,13H2,1-3H3/t16-/s2
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n/an/a 25n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376847
PNG
((R)-(2-ethoxyphenyl)(2-((4-(2- hydroxypropan-2-yl)...)
Show SMILES CCOc1ccccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C22H30N2O4/c1-5-27-18-12-7-6-11-17(18)21(25)24-13-9-8-10-16(24)14-19-23-20(15(2)28-19)22(3,4)26/h6-7,11-12,16,26H,5,8-10,13-14H2,1-4H3/t16-/s2
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n/an/a 28n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376845
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES CC(C)Oc1ncccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C22H31N3O4/c1-14(2)28-20-17(10-8-11-23-20)21(26)25-12-7-6-9-16(25)13-18-24-19(15(3)29-18)22(4,5)27/h8,10-11,14,16,27H,6-7,9,12-13H2,1-5H3/t16-/s2
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n/an/a 36n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376866
PNG
((2-(2,2- difluorocyclopropyl)phenyl)((R)- 2-((4-(2...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CC2(F)F)nc1C(C)(C)O
Show InChI InChI=1/C23H28F2N2O3/c1-14-20(22(2,3)29)26-19(30-14)12-15-8-6-7-11-27(15)21(28)17-10-5-4-9-16(17)18-13-23(18,24)25/h4-5,9-10,15,18,29H,6-8,11-13H2,1-3H3/t15-,18?/s2
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n/an/a 38n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376853
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2-c2ccccc2)nc1C(C)(C)O
Show InChI InChI=1/C25H29N3O3/c1-17-23(25(2,3)30)27-21(31-17)16-19-12-7-8-15-28(19)24(29)20-13-9-14-26-22(20)18-10-5-4-6-11-18/h4-6,9-11,13-14,19,30H,7-8,12,15-16H2,1-3H3/t19-/s2
PDB

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n/an/a 38n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376843
PNG
((R)-(4-fluoro-2-(2H-1,2,3- triazol-2-yl)phenyl)(2-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccc(F)cc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C22H26FN5O3/c1-14-20(22(2,3)30)26-19(31-14)13-16-6-4-5-11-27(16)21(29)17-8-7-15(23)12-18(17)28-24-9-10-25-28/h7-10,12,16,30H,4-6,11,13H2,1-3H3/t16-/s2
PDB

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n/an/a 39n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376869
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cc(C)ccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H29N5O3/c1-15-8-9-19(28-24-10-11-25-28)18(13-15)22(29)27-12-6-5-7-17(27)14-20-26-21(16(2)31-20)23(3,4)30/h8-11,13,17,30H,5-7,12,14H2,1-4H3/t17-/s2
PDB

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n/an/a 46n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376870
PNG
(US9920038, 31)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-c2ncccn2)nc1C(C)(C)O
Show InChI InChI=1S/C24H28N4O3/c1-16-21(24(2,3)30)27-20(31-16)15-17-9-6-7-14-28(17)23(29)19-11-5-4-10-18(19)22-25-12-8-13-26-22/h4-5,8,10-13,17,30H,6-7,9,14-15H2,1-3H3/t17-/m1/s1
PDB

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n/an/a 47n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376855
PNG
((R)-(2-(2,2- difluoroethoxy)pyridin-3-yl)(2- ((4-(...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2OCC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H27F2N3O4/c1-13-18(21(2,3)28)25-17(30-13)11-14-7-4-5-10-26(14)20(27)15-8-6-9-24-19(15)29-12-16(22)23/h6,8-9,14,16,28H,4-5,7,10-12H2,1-3H3/t14-/s2
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n/an/a 49n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376869
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cc(C)ccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H29N5O3/c1-15-8-9-19(28-24-10-11-25-28)18(13-15)22(29)27-12-6-5-7-17(27)14-20-26-21(16(2)31-20)23(3,4)30/h8-11,13,17,30H,5-7,12,14H2,1-4H3/t17-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376846
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2N2CCCC2)nc1C(C)(C)O
Show InChI InChI=1/C24H33N3O3/c1-17-22(24(2,3)29)25-21(30-17)16-18-10-6-7-15-27(18)23(28)19-11-4-5-12-20(19)26-13-8-9-14-26/h4-5,11-12,18,29H,6-10,13-16H2,1-3H3/t18-/s2
PDB

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n/an/a 51n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376852
PNG
((R)-(2-(1H-pyrazol-1- yl)pyridin-3-yl)(2-((4-(2- h...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C22H27N5O3/c1-15-19(22(2,3)29)25-18(30-15)14-16-8-4-5-12-26(16)21(28)17-9-6-10-23-20(17)27-13-7-11-24-27/h6-7,9-11,13,16,29H,4-5,8,12,14H2,1-3H3/t16-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376849
PNG
((R)-(2-(1H-pyrazol-1- yl)phenyl)(2-((4-(2- hydroxy...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H28N4O3/c1-16-21(23(2,3)29)25-20(30-16)15-17-9-6-7-13-26(17)22(28)18-10-4-5-11-19(18)27-14-8-12-24-27/h4-5,8,10-12,14,17,29H,6-7,9,13,15H2,1-3H3/t17-/s2
PDB

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n/an/a 51n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376846
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2N2CCCC2)nc1C(C)(C)O
Show InChI InChI=1/C24H33N3O3/c1-17-22(24(2,3)29)25-21(30-17)16-18-10-6-7-15-27(18)23(28)19-11-4-5-12-20(19)26-13-8-9-14-26/h4-5,11-12,18,29H,6-10,13-16H2,1-3H3/t18-/s2
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376870
PNG
(US9920038, 31)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-c2ncccn2)nc1C(C)(C)O
Show InChI InChI=1S/C24H28N4O3/c1-16-21(24(2,3)30)27-20(31-16)15-17-9-6-7-14-28(17)23(29)19-11-5-4-10-18(19)22-25-12-8-13-26-22/h4-5,8,10-13,17,30H,6-7,9,14-15H2,1-3H3/t17-/m1/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376853
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2-c2ccccc2)nc1C(C)(C)O
Show InChI InChI=1/C25H29N3O3/c1-17-23(25(2,3)30)27-21(31-17)16-19-12-7-8-15-28(19)24(29)20-13-9-14-26-22(20)18-10-5-4-6-11-18/h4-6,9-11,13-14,19,30H,7-8,12,15-16H2,1-3H3/t19-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376851
PNG
((R)-(2-(2,2- difluoroethyl)phenyl)(2-((4-(2- hydro...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H28F2N2O3/c1-14-20(22(2,3)28)25-19(29-14)13-16-9-6-7-11-26(16)21(27)17-10-5-4-8-15(17)12-18(23)24/h4-5,8,10,16,18,28H,6-7,9,11-13H2,1-3H3/t16-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376854
PNG
((R)-(2- (difluoromethoxy)phenyl)(2- ((4-(2-hydroxy...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F2N2O4/c1-13-18(21(2,3)27)24-17(28-13)12-14-8-6-7-11-25(14)19(26)15-9-4-5-10-16(15)29-20(22)23/h4-5,9-10,14,20,27H,6-8,11-12H2,1-3H3/t14-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376856
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OCC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H27F3N2O4/c1-14-19(21(2,3)29)26-18(31-14)12-15-8-6-7-11-27(15)20(28)16-9-4-5-10-17(16)30-13-22(23,24)25/h4-5,9-10,15,29H,6-8,11-13H2,1-3H3/t15-/s2
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n/an/a 99n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376868
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES CCCc1ccccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C23H32N2O3/c1-5-10-17-11-6-7-13-19(17)22(26)25-14-9-8-12-18(25)15-20-24-21(16(2)28-20)23(3,4)27/h6-7,11,13,18,27H,5,8-10,12,14-15H2,1-4H3/t18-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376848
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H25F3N2O4/c1-13-18(20(2,3)28)25-17(29-13)12-14-8-6-7-11-26(14)19(27)15-9-4-5-10-16(15)30-21(22,23)24/h4-5,9-10,14,28H,6-8,11-12H2,1-3H3/t14-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376851
PNG
((R)-(2-(2,2- difluoroethyl)phenyl)(2-((4-(2- hydro...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H28F2N2O3/c1-14-20(22(2,3)28)25-19(29-14)13-16-9-6-7-11-26(16)21(27)17-10-5-4-8-15(17)12-18(23)24/h4-5,8,10,16,18,28H,6-7,9,11-13H2,1-3H3/t16-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376863
PNG
((R)-(2-cyclobutylphenyl)(2-((4- (2-hydroxypropan-2...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CCC2)nc1C(C)(C)O
Show InChI InChI=1/C24H32N2O3/c1-16-22(24(2,3)28)25-21(29-16)15-18-11-6-7-14-26(18)23(27)20-13-5-4-12-19(20)17-9-8-10-17/h4-5,12-13,17-18,28H,6-11,14-15H2,1-3H3/t18-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376857
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H27F3N2O3/c1-14-19(21(2,3)29)26-18(30-14)12-16-9-6-7-11-27(16)20(28)17-10-5-4-8-15(17)13-22(23,24)25/h4-5,8,10,16,29H,6-7,9,11-13H2,1-3H3/t16-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376864
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ncccc2-c2ccccc2)nc1C(C)(C)O
Show InChI InChI=1/C25H29N3O3/c1-17-23(25(2,3)30)27-21(31-17)16-19-12-7-8-15-28(19)24(29)22-20(13-9-14-26-22)18-10-5-4-6-11-18/h4-6,9-11,13-14,19,30H,7-8,12,15-16H2,1-3H3/t19-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376849
PNG
((R)-(2-(1H-pyrazol-1- yl)phenyl)(2-((4-(2- hydroxy...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H28N4O3/c1-16-21(23(2,3)29)25-20(30-16)15-17-9-6-7-13-26(17)22(28)18-10-4-5-11-19(18)27-14-8-12-24-27/h4-5,8,10-12,14,17,29H,6-7,9,13,15H2,1-3H3/t17-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376867
PNG
((R)-(2-(2H-tetrazol-2- yl)phenyl)(2-((4-(2- hydrox...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2ncnn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-19(21(2,3)29)24-18(30-14)12-15-8-6-7-11-26(15)20(28)16-9-4-5-10-17(16)27-23-13-22-25-27/h4-5,9-10,13,15,29H,6-8,11-12H2,1-3H3/t15-/s2
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376841
PNG
(US9920038, 2)
Show SMILES CCOc1ncccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1S/C21H29N3O4/c1-5-27-19-16(10-8-11-22-19)20(25)24-12-7-6-9-15(24)13-17-23-18(14(2)28-17)21(3,4)26/h8,10-11,15,26H,5-7,9,12-13H2,1-4H3/t15-/m1/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376844
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2OCC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F3N3O4/c1-13-17(20(2,3)29)26-16(31-13)11-14-7-4-5-10-27(14)19(28)15-8-6-9-25-18(15)30-12-21(22,23)24/h6,8-9,14,29H,4-5,7,10-12H2,1-3H3/t14-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376863
PNG
((R)-(2-cyclobutylphenyl)(2-((4- (2-hydroxypropan-2...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CCC2)nc1C(C)(C)O
Show InChI InChI=1/C24H32N2O3/c1-16-22(24(2,3)28)25-21(29-16)15-18-11-6-7-14-26(18)23(27)20-13-5-4-12-19(20)17-9-8-10-17/h4-5,12-13,17-18,28H,6-11,14-15H2,1-3H3/t18-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376865
PNG
((R)-(3-(1H-pyrazol-1- yl)pyrazin-2-yl)(2-((4-(2- h...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-18(21(2,3)29)25-16(30-14)13-15-7-4-5-11-26(15)20(28)17-19(23-10-9-22-17)27-12-6-8-24-27/h6,8-10,12,15,29H,4-5,7,11,13H2,1-3H3/t15-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376842
PNG
((R)-(2-cyclopropylphenyl)(2- ((4-(2-hydroxypropan-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CC2)nc1C(C)(C)O
Show InChI InChI=1/C23H30N2O3/c1-15-21(23(2,3)27)24-20(28-15)14-17-8-6-7-13-25(17)22(26)19-10-5-4-9-18(19)16-11-12-16/h4-5,9-10,16-17,27H,6-8,11-14H2,1-3H3/t17-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376845
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES CC(C)Oc1ncccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C22H31N3O4/c1-14(2)28-20-17(10-8-11-23-20)21(26)25-12-7-6-9-16(25)13-18-24-19(15(3)29-18)22(4,5)27/h8,10-11,14,16,27H,6-7,9,12-13H2,1-5H3/t16-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376860
PNG
((R)-(3-(2H-1,2,3-triazol-2- yl)pyridin-2-yl)(2-((4...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ncccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-19(21(2,3)29)25-17(30-14)13-15-7-4-5-12-26(15)20(28)18-16(8-6-9-22-18)27-23-10-11-24-27/h6,8-11,15,29H,4-5,7,12-13H2,1-3H3/t15-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376864
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ncccc2-c2ccccc2)nc1C(C)(C)O
Show InChI InChI=1/C25H29N3O3/c1-17-23(25(2,3)30)27-21(31-17)16-19-12-7-8-15-28(19)24(29)22-20(13-9-14-26-22)18-10-5-4-6-11-18/h4-6,9-11,13-14,19,30H,7-8,12,15-16H2,1-3H3/t19-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376847
PNG
((R)-(2-ethoxyphenyl)(2-((4-(2- hydroxypropan-2-yl)...)
Show SMILES CCOc1ccccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C22H30N2O4/c1-5-27-18-12-7-6-11-17(18)21(25)24-13-9-8-10-16(24)14-19-23-20(15(2)28-19)22(3,4)26/h6-7,11-12,16,26H,5,8-10,13-14H2,1-4H3/t16-/s2
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n/an/a 256n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376848
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H25F3N2O4/c1-13-18(20(2,3)28)25-17(29-13)12-14-8-6-7-11-26(14)19(27)15-9-4-5-10-16(15)30-21(22,23)24/h4-5,9-10,14,28H,6-8,11-12H2,1-3H3/t14-/s2
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n/an/a 348n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376855
PNG
((R)-(2-(2,2- difluoroethoxy)pyridin-3-yl)(2- ((4-(...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2OCC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H27F2N3O4/c1-13-18(21(2,3)28)25-17(30-13)11-14-7-4-5-10-26(14)20(27)15-8-6-9-24-19(15)29-12-16(22)23/h6,8-9,14,16,28H,4-5,7,10-12H2,1-3H3/t14-/s2
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n/an/a 373n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376866
PNG
((2-(2,2- difluorocyclopropyl)phenyl)((R)- 2-((4-(2...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2C2CC2(F)F)nc1C(C)(C)O
Show InChI InChI=1/C23H28F2N2O3/c1-14-20(22(2,3)29)26-19(30-14)12-15-8-6-7-11-27(15)21(28)17-10-5-4-9-16(17)18-13-23(18,24)25/h4-5,9-10,15,18,29H,6-8,11-13H2,1-3H3/t15-,18?/s2
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n/an/a 473n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376867
PNG
((R)-(2-(2H-tetrazol-2- yl)phenyl)(2-((4-(2- hydrox...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2-n2ncnn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-19(21(2,3)29)24-18(30-14)12-15-8-6-7-11-26(15)20(28)16-9-4-5-10-17(16)27-23-13-22-25-27/h4-5,9-10,13,15,29H,6-8,11-12H2,1-3H3/t15-/s2
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n/an/a 486n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376858
PNG
((R)-(2-cyclopropyl-6- methoxypyridin-3-yl)(2-((4-(...)
Show SMILES COc1ccc(C(=O)N2CCCC[C@@H]2Cc2nc(c(C)o2)C(C)(C)O)c(n1)C1CC1
Show InChI InChI=1/C23H31N3O4/c1-14-21(23(2,3)28)25-19(30-14)13-16-7-5-6-12-26(16)22(27)17-10-11-18(29-4)24-20(17)15-8-9-15/h10-11,15-16,28H,5-9,12-13H2,1-4H3/t16-/s2
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n/an/a 503n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376861
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2-c2ccccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H27N5O3/c1-15-21(23(2,3)30)27-18(31-15)14-16-8-5-7-13-28(16)22(29)20-19(25-11-12-26-20)17-9-4-6-10-24-17/h4,6,9-12,16,30H,5,7-8,13-14H2,1-3H3/t16-/s2
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n/an/a 558n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376851
PNG
((R)-(2-(2,2- difluoroethyl)phenyl)(2-((4-(2- hydro...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H28F2N2O3/c1-14-20(22(2,3)28)25-19(29-14)13-16-9-6-7-11-26(16)21(27)17-10-5-4-8-15(17)12-18(23)24/h4-5,8,10,16,18,28H,6-7,9,11-13H2,1-3H3/t16-/s2
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n/an/a 690n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376868
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES CCCc1ccccc1C(=O)N1CCCC[C@@H]1Cc1nc(c(C)o1)C(C)(C)O
Show InChI InChI=1/C23H32N2O3/c1-5-10-17-11-6-7-13-19(17)22(26)25-14-9-8-12-18(25)15-20-24-21(16(2)28-20)23(3,4)27/h6-7,11,13,18,27H,5,8-10,12,14-15H2,1-4H3/t18-/s2
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n/an/a 794n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376856
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OCC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H27F3N2O4/c1-14-19(21(2,3)29)26-18(31-14)12-15-8-6-7-11-27(15)20(28)16-9-4-5-10-17(16)30-13-22(23,24)25/h4-5,9-10,15,29H,6-8,11-13H2,1-3H3/t15-/s2
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n/an/a 952n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376854
PNG
((R)-(2- (difluoromethoxy)phenyl)(2- ((4-(2-hydroxy...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2OC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F2N2O4/c1-13-18(21(2,3)27)24-17(28-13)12-14-8-6-7-11-25(14)19(26)15-9-4-5-10-16(15)29-20(22)23/h4-5,9-10,14,20,27H,6-8,11-12H2,1-3H3/t14-/s2
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n/an/a 1.09E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376865
PNG
((R)-(3-(1H-pyrazol-1- yl)pyrazin-2-yl)(2-((4-(2- h...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2-n2cccn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-18(21(2,3)29)25-16(30-14)13-15-7-4-5-11-26(15)20(28)17-19(23-10-9-22-17)27-12-6-8-24-27/h6,8-10,12,15,29H,4-5,7,11,13H2,1-3H3/t15-/s2
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n/an/a 1.41E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376850
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2CC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F3N3O3/c1-13-18(20(2,3)29)26-17(30-13)11-14-7-4-5-10-27(14)19(28)15-8-6-9-25-16(15)12-21(22,23)24/h6,8-9,14,29H,4-5,7,10-12H2,1-3H3/t14-/s2
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n/an/a 1.47E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376857
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H27F3N2O3/c1-14-19(21(2,3)29)26-18(30-14)12-16-9-6-7-11-27(16)20(28)17-10-5-4-8-15(17)13-22(23,24)25/h4-5,8,10,16,29H,6-7,9,11-13H2,1-3H3/t16-/s2
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n/an/a 1.69E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376860
PNG
((R)-(3-(2H-1,2,3-triazol-2- yl)pyridin-2-yl)(2-((4...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ncccc2-n2nccn2)nc1C(C)(C)O
Show InChI InChI=1/C21H26N6O3/c1-14-19(21(2,3)29)25-17(30-14)13-15-7-4-5-12-26(15)20(28)18-16(8-6-9-22-18)27-23-10-11-24-27/h6,8-11,15,29H,4-5,7,12-13H2,1-3H3/t15-/s2
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n/an/a 1.85E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376851
PNG
((R)-(2-(2,2- difluoroethyl)phenyl)(2-((4-(2- hydro...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2ccccc2CC(F)F)nc1C(C)(C)O
Show InChI InChI=1/C22H28F2N2O3/c1-14-20(22(2,3)28)25-19(29-14)13-16-9-6-7-11-26(16)21(27)17-10-5-4-8-15(17)12-18(23)24/h4-5,8,10,16,18,28H,6-7,9,11-13H2,1-3H3/t16-/s2
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n/an/a 2.18E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376858
PNG
((R)-(2-cyclopropyl-6- methoxypyridin-3-yl)(2-((4-(...)
Show SMILES COc1ccc(C(=O)N2CCCC[C@@H]2Cc2nc(c(C)o2)C(C)(C)O)c(n1)C1CC1
Show InChI InChI=1/C23H31N3O4/c1-14-21(23(2,3)28)25-19(30-14)13-16-7-5-6-12-26(16)22(27)17-10-11-18(29-4)24-20(17)15-8-9-15/h10-11,15-16,28H,5-9,12-13H2,1-4H3/t16-/s2
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n/an/a 2.31E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376861
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2-c2ccccn2)nc1C(C)(C)O
Show InChI InChI=1/C23H27N5O3/c1-15-21(23(2,3)30)27-18(31-15)14-16-8-5-7-13-28(16)22(29)20-19(25-11-12-26-20)17-9-4-6-10-24-17/h4,6,9-12,16,30H,5,7-8,13-14H2,1-3H3/t16-/s2
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n/an/a 2.93E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376862
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2C2CCCC2)nc1C(C)(C)O
Show InChI InChI=1/C23H32N4O3/c1-15-21(23(2,3)29)26-18(30-15)14-17-10-6-7-13-27(17)22(28)20-19(24-11-12-25-20)16-8-4-5-9-16/h11-12,16-17,29H,4-10,13-14H2,1-3H3/t17-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM376862
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2nccnc2C2CCCC2)nc1C(C)(C)O
Show InChI InChI=1/C23H32N4O3/c1-15-21(23(2,3)29)26-18(30-15)14-17-10-6-7-13-27(17)22(28)20-19(24-11-12-25-20)16-8-4-5-9-16/h11-12,16-17,29H,4-10,13-14H2,1-3H3/t17-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

More data for this
Ligand-Target Pair
Orexin receptor type 1 (OX1)


(Rattus norvegicus (Rat))
BDBM376850
PNG
((R)-(2-((4-(2-hydroxypropan-2- yl)-5-methyloxazol-...)
Show SMILES Cc1oc(C[C@H]2CCCCN2C(=O)c2cccnc2CC(F)(F)F)nc1C(C)(C)O
Show InChI InChI=1/C21H26F3N3O3/c1-13-18(20(2,3)29)26-17(30-13)11-14-7-4-5-10-27(14)19(28)15-8-6-9-25-16(15)12-21(22,23)24/h6,8-9,14,29H,4-5,7,10-12H2,1-3H3/t14-/s2
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UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...


US Patent US9920038 (2018)

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