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Compile Data Set for Download or QSAR

Found 18 hits of ki for monomerid = 143784   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55 -9.20n/an/an/an/an/an/a4



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM 001525) or Chinese ovary cells (CHO) ...


US Patent US8969352 (2015)


BindingDB Entry DOI: 10.7270/Q2FB51PC
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Rat and Human Orexin 1 Receptor:Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_00152...


US Patent US9845333 (2017)


BindingDB Entry DOI: 10.7270/Q21838TW
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
CHO cells stably transfected with the human orexin 1 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM/F12, 10% FBS, 1×...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
CHO cells stably transfected with the human orexin 1 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM/F12, 10% FBS, 1×...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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55n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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60n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Rat and Human Orexin 1 Receptor:Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_00152...


US Patent US9845333 (2017)


BindingDB Entry DOI: 10.7270/Q21838TW
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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60n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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60n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
PDB

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60n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
PDB

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60n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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60 -9.15n/an/an/an/an/an/a4



Janssen Pharmaceutica NV

US Patent


Assay Description
Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM 001525) or Chinese ovary cells (CHO) ...


US Patent US8969352 (2015)


BindingDB Entry DOI: 10.7270/Q2FB51PC
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Rattus norvegicus (Rat))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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1.50E+3n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Human Orexin 2 Receptor:HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hycl...


US Patent US9845333 (2017)


BindingDB Entry DOI: 10.7270/Q21838TW
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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1.50E+3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM 001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...


US Patent US8969352 (2015)


BindingDB Entry DOI: 10.7270/Q2FB51PC
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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1.50E+3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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1.50E+3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
PFSK-1 cells endogenously expressing the human orexin 2 receptor were grown to confluency in RPMI1640 (Hyclone, cat #30027.02), 10% FBS, 1× pen-strep...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
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1.50E+3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...


US Patent US9611277 (2017)


BindingDB Entry DOI: 10.7270/Q24B33D2
More data for this
Ligand-Target Pair
Orexin receptor type 2


(Homo sapiens (Human))
BDBM143784
PNG
(US10183953, Example 45 | US8969352, 45 | US9611277...)
Show SMILES Fc1cccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c1Br |TLB:13:12:8.9:25,6:8:12.11:25|
Show InChI InChI=1S/C19H15BrF4N2O2/c20-17-12(2-1-3-13(17)21)18(27)26-9-10-6-14(26)15(7-10)28-16-5-4-11(8-25-16)19(22,23)24/h1-5,8,10,14-15H,6-7,9H2
PDB

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1.50E+3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
PFSK-1 cells endogenously expressing the human orexin 2 receptor were grown to confluency in RPMI1640 (Hyclone, cat #30027.02), 10% FBS, 1× pen-strep...


US Patent US10183953 (2019)


BindingDB Entry DOI: 10.7270/Q2Z60R5Q
More data for this
Ligand-Target Pair