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Patent code US9663530

Compile Data Set for Download or QSAR
Found 136 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
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330195
PNG
(3-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-14(8-15)18(23)22-16-6-4-13(5-7-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m1/s1
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n/an/a 2.20n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330161
PNG
((RS)-4-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-1-13(2-6-15)18(23)22-16-7-3-14(4-8-16)19-10-9-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)
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n/an/a 2.80n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330177
PNG
(4-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-3-14(4-6-15)18(23)22-16-7-1-13(2-8-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330211
PNG
(3-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-3-1-2-12(8-14)17(22)21-15-6-4-13(5-7-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m1/s1
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n/an/a 3.60n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330162
PNG
(3-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-4-yl...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-13(10-15)18(23)22-16-6-4-14(5-7-16)19-9-8-17(11-24-19)21-12-19/h1-7,10,17,21H,8-9,11-12H2,(H,22,23)
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n/an/a 4.40n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330200
PNG
(1-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-2-1-3-16(8-14)26-18(27)25-15-6-4-13(5-7-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330222
PNG
((RS)-1-(4-Chlorophenyl)-3-[4-(5-oxa-2-azabicyclo[2...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)19-10-9-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330215
PNG
(3-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-3-1-2-12(8-14)17(22)21-15-6-4-13(5-7-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330210
PNG
(4-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-5-1-12(2-6-14)17(22)21-15-7-3-13(4-8-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330201
PNG
(4-(Cyclopropylmethoxy)-N-[4-[[(1R,4R)-5-oxa-2-azab...)
Show SMILES O=C(Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(18-5-9-21(10-6-18)27-13-17-1-2-17)25-19-7-3-16(4-8-19)11-23-12-20(14-28-23)24-15-23/h3-10,17,20,24H,1-2,11-15H2,(H,25,26)/t20-,23-/m1/s1
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n/an/a 6.10n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330176
PNG
(5-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(Nc2ccc(cc2)[C@@]23CN[C@@H](CO2)C3)nc1
Show InChI InChI=1S/C16H16ClN3O/c17-12-3-6-15(18-8-12)20-13-4-1-11(2-5-13)16-7-14(9-21-16)19-10-16/h1-6,8,14,19H,7,9-10H2,(H,18,20)/t14-,16-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330205
PNG
(4-Ethoxy-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-5-16(6-10-19)20(24)23-17-7-3-15(4-8-17)11-21-12-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)/t18-,21-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330180
PNG
(1-(3-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(8-14)23-18(24)22-15-6-4-13(5-7-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m1/s1
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n/an/a 8.60n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330203
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-3-14(9-24-17)18(27)26-15-4-1-13(2-5-15)7-19-8-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)/t16-,19-/m1/s1
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n/an/a 10.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330203
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-3-14(9-24-17)18(27)26-15-4-1-13(2-5-15)7-19-8-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)/t16-,19-/m1/s1
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n/an/a 10.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330219
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)7-17-8-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)/t15-,17-/m1/s1
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n/an/a 10.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330200
PNG
(1-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-2-1-3-16(8-14)26-18(27)25-15-6-4-13(5-7-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330160
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(cc2)C23CCC(CO2)NC3)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)17-8-7-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330224
PNG
((RS)-1-(3-Chlorophenyl)-3-[4-(5-oxa-2-azabicyclo[2...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(10-14)23-18(24)22-15-6-4-13(5-7-15)19-9-8-17(11-25-19)21-12-19/h1-7,10,17,21H,8-9,11-12H2,(H2,22,23,24)
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n/an/a 11.9n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330199
PNG
(1-(2-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccccc1NC(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-16-3-1-2-4-17(16)23-18(24)22-14-7-5-13(6-8-14)9-19-10-15(11-25-19)21-12-19/h1-8,15,21H,9-12H2,(H2,22,23,24)/t15-,19-/m1/s1
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n/an/a 12.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330178
PNG
(1-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m1/s1
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n/an/a 12.6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330183
PNG
(N-[4-[[(1 S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-3-14(9-24-17)18(27)26-15-4-1-13(2-5-15)7-19-8-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)/t16-,19-/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330190
PNG
((RS)-4-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)19-9-8-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)
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n/an/a 13.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330223
PNG
((RS)-1-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phe...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)19-10-9-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)
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n/an/a 13.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330179
PNG
(1-(4-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m1/s1
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n/an/a 13.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330159
PNG
((RS)-5-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES Clc1ccc(Nc2ccc(cc2)C23CCC(CO2)NC3)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)17-8-7-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330202
PNG
(6-Ethoxy-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-5-15(11-21-18)19(24)23-16-6-3-14(4-7-16)9-20-10-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)/t17-,20-/m1/s1
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n/an/a 14.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330217
PNG
(N-[4-[(1 S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)nc1
Show InChI InChI=1S/C17H16F3N3O/c18-17(19,20)12-3-6-15(21-8-12)23-13-4-1-11(2-5-13)16-7-14(9-24-16)22-10-16/h1-6,8,14,22H,7,9-10H2,(H,21,23)/t14-,16-/m0/s1
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n/an/a 14.6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330204
PNG
(4-Chloro-3-cyclopropyl-N-[4-[[(1R,4R)-5-oxa-2-azab...)
Show SMILES Clc1c(n[nH]c1C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)C1CC1
Show InChI InChI=1S/C19H21ClN4O2/c20-15-16(12-3-4-12)23-24-17(15)18(25)22-13-5-1-11(2-6-13)7-19-8-14(9-26-19)21-10-19/h1-2,5-6,12,14,21H,3-4,7-10H2,(H,22,25)(H,23,24)/t14-,19-/m1/s1
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n/an/a 14.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330209
PNG
(4-Ethoxy-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-4-yl...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-3-15(4-10-19)20(24)23-17-7-5-16(6-8-17)21-12-11-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)
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n/an/a 15.6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330198
PNG
(5-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m1/s1
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n/an/a 15.8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330214
PNG
(4-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-5-1-12(2-6-14)17(22)21-15-7-3-13(4-8-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330181
PNG
(4-(Cyclopropylmethoxy)-N-[4-[[(1S,4S)-5-oxa-2-azab...)
Show SMILES O=C(Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(18-5-9-21(10-6-18)27-13-17-1-2-17)25-19-7-3-16(4-8-19)11-23-12-20(14-28-23)24-15-23/h3-10,17,20,24H,1-2,11-15H2,(H,25,26)/t20-,23-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330197
PNG
(4-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)8-19-9-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)/t14-,19-/m1/s1
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n/an/a 18.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330167
PNG
((RS)-4-(Cyclopropylmethoxy)-N-[4-(5-oxa-2-azabicyc...)
Show SMILES O=C(Nc1ccc(cc1)C12CCC(CO1)NC2)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(17-3-9-21(10-4-17)27-13-16-1-2-16)25-19-7-5-18(6-8-19)23-12-11-20(14-28-23)24-15-23/h3-10,16,20,24H,1-2,11-15H2,(H,25,26)
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n/an/a 19n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330166
PNG
(1-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-2-1-3-16(8-14)26-18(27)25-15-6-4-13(5-7-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330201
PNG
(4-(Cyclopropylmethoxy)-N-[4-[[(1R,4R)-5-oxa-2-azab...)
Show SMILES O=C(Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(18-5-9-21(10-6-18)27-13-17-1-2-17)25-19-7-3-16(4-8-19)11-23-12-20(14-28-23)24-15-23/h3-10,17,20,24H,1-2,11-15H2,(H,25,26)/t20-,23-/m1/s1
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n/an/a 21.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330168
PNG
((RS)-6-Ethoxy-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-3-14(11-21-18)19(24)23-16-6-4-15(5-7-16)20-10-9-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330178
PNG
(1-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330223
PNG
((RS)-1-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phe...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)19-10-9-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)
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n/an/a 26.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330217
PNG
(N-[4-[(1 S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)nc1
Show InChI InChI=1S/C17H16F3N3O/c18-17(19,20)12-3-6-15(21-8-12)23-13-4-1-11(2-5-13)16-7-14(9-24-16)22-10-16/h1-6,8,14,22H,7,9-10H2,(H,21,23)/t14-,16-/m0/s1
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n/an/a 29.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330198
PNG
(5-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330169
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-1-13(9-24-17)18(27)26-15-4-2-14(3-5-15)19-8-7-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)
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n/an/a 30.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330179
PNG
(1-(4-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m1/s1
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n/an/a 37.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330193
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-9-12(6-8-23-16)17(26)25-14-3-1-13(2-4-14)18-7-5-15(10-27-18)24-11-18/h1-4,6,8-9,15,24H,5,7,10-11H2,(H,25,26)
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n/an/a 37.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330212
PNG
(N-[4-[(1R,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)[C@@]23CN[C@@H](CO2)C3)n1
Show InChI InChI=1S/C16H15F3N4O/c17-16(18,19)14-20-6-5-13(23-14)22-11-3-1-10(2-4-11)15-7-12(8-24-15)21-9-15/h1-6,12,21H,7-9H2,(H,20,22,23)/t12-,15-/m1/s1
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n/an/a 39.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330163
PNG
(5-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)nc1
Show InChI InChI=1S/C16H16ClN3O/c17-12-3-6-15(18-8-12)20-13-4-1-11(2-5-13)16-7-14(9-21-16)19-10-16/h1-6,8,14,19H,7,9-10H2,(H,18,20)/t14-,16-/m0/s1
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n/an/a 41.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330164
PNG
(1-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m0/s1
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n/an/a 44.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330222
PNG
((RS)-1-(4-Chlorophenyl)-3-[4-(5-oxa-2-azabicyclo[2...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)19-10-9-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)
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n/an/a 46.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330192
PNG
(N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phenyl]-...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)C23CCC(CO2)NC3)n1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)15-21-8-6-14(24-15)23-12-3-1-11(2-4-12)16-7-5-13(9-25-16)22-10-16/h1-4,6,8,13,22H,5,7,9-10H2,(H,21,23,24)
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n/an/a 47.1n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330171
PNG
(4-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-3-14(4-6-15)18(23)22-16-7-1-13(2-8-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m0/s1
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n/an/a 50.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330216
PNG
(N-[4-[(1S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H16F3N3O2/c19-18(20,21)15-7-11(5-6-22-15)16(25)24-13-3-1-12(2-4-13)17-8-14(9-26-17)23-10-17/h1-7,14,23H,8-10H2,(H,24,25)/t14-,17-/m0/s1
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n/an/a 51.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330196
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-7-13(5-6-23-16)17(26)25-14-3-1-12(2-4-14)8-18-9-15(10-27-18)24-11-18/h1-7,15,24H,8-11H2,(H,25,26)/t15-,18-/m1/s1
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n/an/a 52.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330195
PNG
(3-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-14(8-15)18(23)22-16-6-4-13(5-7-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m1/s1
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n/an/a 55.1n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330183
PNG
(N-[4-[[(1 S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-3-14(9-24-17)18(27)26-15-4-1-13(2-5-15)7-19-8-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)/t16-,19-/m0/s1
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n/an/a 55.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330213
PNG
(N-[4-[(1R,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H16F3N3O2/c19-18(20,21)15-7-11(5-6-22-15)16(25)24-13-3-1-12(2-4-13)17-8-14(9-26-17)23-10-17/h1-7,14,23H,8-10H2,(H,24,25)/t14-,17-/m1/s1
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n/an/a 59.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330180
PNG
(1-(3-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(8-14)23-18(24)22-15-6-4-13(5-7-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m1/s1
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n/an/a 61.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330177
PNG
(4-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-3-14(4-6-15)18(23)22-16-7-1-13(2-8-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m1/s1
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n/an/a 62.6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330175
PNG
(4-Ethoxy-N-[4-[[(1 S,4S)-5-oxa-2-azabicyclo[2.2.1]...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-5-16(6-10-19)20(24)23-17-7-3-15(4-8-17)11-21-12-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)/t18-,21-/m0/s1
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n/an/a 63n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330197
PNG
(4-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)8-19-9-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)/t14-,19-/m1/s1
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n/an/a 66n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330224
PNG
((RS)-1-(3-Chlorophenyl)-3-[4-(5-oxa-2-azabicyclo[2...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(10-14)23-18(24)22-15-6-4-13(5-7-15)19-9-8-17(11-25-19)21-12-19/h1-7,10,17,21H,8-9,11-12H2,(H2,22,23,24)
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n/an/a 68.1n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330214
PNG
(4-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-5-1-12(2-6-14)17(22)21-15-7-3-13(4-8-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330215
PNG
(3-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-3-1-2-12(8-14)17(22)21-15-6-4-13(5-7-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m0/s1
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n/an/a 77.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330207
PNG
(2-Cyclopropyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2....)
Show SMILES O=C(Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(15-9-21-18(22-10-15)14-3-4-14)24-16-5-1-13(2-6-16)7-20-8-17(11-26-20)23-12-20/h1-2,5-6,9-10,14,17,23H,3-4,7-8,11-12H2,(H,24,25)/t17-,20-/m1/s1
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n/an/a 77.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330158
PNG
(1-(3-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(8-14)23-18(24)22-15-6-4-13(5-7-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m0/s1
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n/an/a 82.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330171
PNG
(4-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-3-14(4-6-15)18(23)22-16-7-1-13(2-8-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m0/s1
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n/an/a 85.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330190
PNG
((RS)-4-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)19-9-8-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)
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n/an/a 97.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330196
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-7-13(5-6-23-16)17(26)25-14-3-1-12(2-4-14)8-18-9-15(10-27-18)24-11-18/h1-7,15,24H,8-11H2,(H,25,26)/t15-,18-/m1/s1
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n/an/a 98.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330173
PNG
(3-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-14(8-15)18(23)22-16-6-4-13(5-7-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m0/s1
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n/an/a 112n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330204
PNG
(4-Chloro-3-cyclopropyl-N-[4-[[(1R,4R)-5-oxa-2-azab...)
Show SMILES Clc1c(n[nH]c1C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)C1CC1
Show InChI InChI=1S/C19H21ClN4O2/c20-15-16(12-3-4-12)23-24-17(15)18(25)22-13-5-1-11(2-6-13)7-19-8-14(9-26-19)21-10-19/h1-2,5-6,12,14,21H,3-4,7-10H2,(H,22,25)(H,23,24)/t14-,19-/m1/s1
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n/an/a 112n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330221
PNG
(US9663530, Example 65)
Show SMILES Clc1ccc(Nc2ccc(C[C@]34CCC(CO3)NC4)cc2)nc1
Show InChI InChI=1S/C18H20ClN3O/c19-14-3-6-17(20-10-14)22-15-4-1-13(2-5-15)9-18-8-7-16(11-23-18)21-12-18/h1-6,10,16,21H,7-9,11-12H2,(H,20,22)/t16?,18-/m0/s1
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n/an/a 122n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330170
PNG
((RS)-2-Cyclopropyl-N-[4-(5-oxa-2-azabicyclo[2.2.2]...)
Show SMILES O=C(Nc1ccc(cc1)C12CCC(CO1)NC2)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(14-9-21-18(22-10-14)13-1-2-13)24-16-5-3-15(4-6-16)20-8-7-17(11-26-20)23-12-20/h3-6,9-10,13,17,23H,1-2,7-8,11-12H2,(H,24,25)
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n/an/a 136n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330219
PNG
(N-[4-[[(1R,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)7-17-8-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)/t15-,17-/m1/s1
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n/an/a 141n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330205
PNG
(4-Ethoxy-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-5-16(6-10-19)20(24)23-17-7-3-15(4-8-17)11-21-12-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)/t18-,21-/m1/s1
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n/an/a 142n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330218
PNG
(N-[4-[(1S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)n1
Show InChI InChI=1S/C16H15F3N4O/c17-16(18,19)14-20-6-5-13(23-14)22-11-3-1-10(2-4-11)15-7-12(8-24-15)21-9-15/h1-6,12,21H,7-9H2,(H,20,22,23)/t12-,15-/m0/s1
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n/an/a 144n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330191
PNG
((RS)-2-Ethyl-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-...)
Show SMILES CCc1ncc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H22N4O2/c1-2-17-20-9-13(10-21-17)18(24)23-15-5-3-14(4-6-15)19-8-7-16(11-25-19)22-12-19/h3-6,9-10,16,22H,2,7-8,11-12H2,1H3,(H,23,24)
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n/an/a 153n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330187
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)7-17-8-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)/t15-,17-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330181
PNG
(4-(Cyclopropylmethoxy)-N-[4-[[(1S,4S)-5-oxa-2-azab...)
Show SMILES O=C(Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(18-5-9-21(10-6-18)27-13-17-1-2-17)25-19-7-3-16(4-8-19)11-23-12-20(14-28-23)24-15-23/h3-10,17,20,24H,1-2,11-15H2,(H,25,26)/t20-,23-/m0/s1
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n/an/a 168n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330199
PNG
(1-(2-Chlorophenyl)-3-[4-[[(1R,4R)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccccc1NC(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-16-3-1-2-4-17(16)23-18(24)22-14-7-5-13(6-8-14)9-19-10-15(11-25-19)21-12-19/h1-8,15,21H,9-12H2,(H2,22,23,24)/t15-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330206
PNG
(2-Ethyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES CCc1ncc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H22N4O2/c1-2-17-20-9-14(10-21-17)18(24)23-15-5-3-13(4-6-15)7-19-8-16(11-25-19)22-12-19/h3-6,9-10,16,22H,2,7-8,11-12H2,1H3,(H,23,24)/t16-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330173
PNG
(3-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-14(8-15)18(23)22-16-6-4-13(5-7-16)9-19-10-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)/t17-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330218
PNG
(N-[4-[(1S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)n1
Show InChI InChI=1S/C16H15F3N4O/c17-16(18,19)14-20-6-5-13(23-14)22-11-3-1-10(2-4-11)15-7-12(8-24-15)21-9-15/h1-6,12,21H,7-9H2,(H,20,22,23)/t12-,15-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330174
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-7-13(5-6-23-16)17(26)25-14-3-1-12(2-4-14)8-18-9-15(10-27-18)24-11-18/h1-7,15,24H,8-11H2,(H,25,26)/t15-,18-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330216
PNG
(N-[4-[(1S,4R)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@]12CN[C@H](CO1)C2
Show InChI InChI=1S/C18H16F3N3O2/c19-18(20,21)15-7-11(5-6-22-15)16(25)24-13-3-1-12(2-4-13)17-8-14(9-26-17)23-10-17/h1-7,14,23H,8-10H2,(H,24,25)/t14-,17-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330172
PNG
(4-Chloro-N-[4-[[(1 S,4S)-5-oxa-2-azabicyclo[2.2.1]...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)8-19-9-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)/t14-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330208
PNG
(3-Isopropyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2....)
Show SMILES CC(C)c1cc([nH]n1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H24N4O2/c1-12(2)16-7-17(23-22-16)18(24)21-14-5-3-13(4-6-14)8-19-9-15(10-25-19)20-11-19/h3-7,12,15,20H,8-11H2,1-2H3,(H,21,24)(H,22,23)/t15-,19-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330163
PNG
(5-Chloro-N-[4-[(1S,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(Nc2ccc(cc2)[C@]23CN[C@H](CO2)C3)nc1
Show InChI InChI=1S/C16H16ClN3O/c17-12-3-6-15(18-8-12)20-13-4-1-11(2-5-13)16-7-14(9-21-16)19-10-16/h1-6,8,14,19H,7,9-10H2,(H,18,20)/t14-,16-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330207
PNG
(2-Cyclopropyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2....)
Show SMILES O=C(Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(15-9-21-18(22-10-15)14-3-4-14)24-16-5-1-13(2-6-16)7-20-8-17(11-26-20)23-12-20/h1-2,5-6,9-10,14,17,23H,3-4,7-8,11-12H2,(H,24,25)/t17-,20-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330160
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(cc2)C23CCC(CO2)NC3)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)17-8-7-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330175
PNG
(4-Ethoxy-N-[4-[[(1 S,4S)-5-oxa-2-azabicyclo[2.2.1]...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-5-16(6-10-19)20(24)23-17-7-3-15(4-8-17)11-21-12-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)/t18-,21-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330174
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-7-13(5-6-23-16)17(26)25-14-3-1-12(2-4-14)8-18-9-15(10-27-18)24-11-18/h1-7,15,24H,8-11H2,(H,25,26)/t15-,18-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330198
PNG
(5-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330184
PNG
(2-Cyclopropyl-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2....)
Show SMILES O=C(Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(15-9-21-18(22-10-15)14-3-4-14)24-16-5-1-13(2-6-16)7-20-8-17(11-26-20)23-12-20/h1-2,5-6,9-10,14,17,23H,3-4,7-8,11-12H2,(H,24,25)/t17-,20-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330166
PNG
(1-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-2-1-3-16(8-14)26-18(27)25-15-6-4-13(5-7-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330182
PNG
(6-Ethoxy-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-5-15(11-21-18)19(24)23-16-6-3-14(4-7-16)9-20-10-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)/t17-,20-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330194
PNG
(3-Isopropyl-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2....)
Show SMILES CC(C)c1cc([nH]n1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H24N4O2/c1-12(2)16-7-17(23-22-16)18(24)21-14-5-3-13(4-6-14)8-19-9-15(10-25-19)20-11-19/h3-7,12,15,20H,8-11H2,1-2H3,(H,21,24)(H,22,23)/t15-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330202
PNG
(6-Ethoxy-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-5-15(11-21-18)19(24)23-16-6-3-14(4-7-16)9-20-10-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)/t17-,20-/m1/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330172
PNG
(4-Chloro-N-[4-[[(1 S,4S)-5-oxa-2-azabicyclo[2.2.1]...)
Show SMILES CCCc1n[nH]c(C(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1Cl
Show InChI InChI=1S/C19H23ClN4O2/c1-2-3-15-16(20)17(24-23-15)18(25)22-13-6-4-12(5-7-13)8-19-9-14(10-26-19)21-11-19/h4-7,14,21H,2-3,8-11H2,1H3,(H,22,25)(H,23,24)/t14-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330185
PNG
(4-Chloro-3-cyclopropyl-N-[4-[[(1 S,4S)-5-oxa-2-aza...)
Show SMILES ClC1=C(N[H]=C1C1CC1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H22ClN3O2/c20-15-16(23-26-17(15)12-3-4-12)18(24)22-13-5-1-11(2-6-13)7-19-8-14(9-25-19)21-10-19/h1-2,5-6,12,14,21,23H,3-4,7-10H2,(H,22,24)/t14-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330165
PNG
(1-(2-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccccc1NC(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-16-3-1-2-4-17(16)23-18(24)22-14-7-5-13(6-8-14)9-19-10-15(11-25-19)21-12-19/h1-8,15,21H,9-12H2,(H2,22,23,24)/t15-,19-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330186
PNG
(5-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m0/s1
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330169
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)COc1ccc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C20H20F3N3O3/c21-20(22,23)12-28-17-6-1-13(9-24-17)18(27)26-15-4-2-14(3-5-15)19-8-7-16(10-29-19)25-11-19/h1-6,9,16,25H,7-8,10-12H2,(H,26,27)
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Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330185
PNG
(4-Chloro-3-cyclopropyl-N-[4-[[(1 S,4S)-5-oxa-2-aza...)
Show SMILES ClC1=C(N[H]=C1C1CC1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H22ClN3O2/c20-15-16(23-26-17(15)12-3-4-12)18(24)22-13-5-1-11(2-6-13)7-19-8-14(9-25-19)21-10-19/h1-2,5-6,12,14,21,23H,3-4,7-10H2,(H,22,24)/t14-,19-/m0/s1
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n/an/a 633n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330161
PNG
((RS)-4-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H19ClN2O2/c20-15-5-1-13(2-6-15)18(23)22-16-7-3-14(4-8-16)19-10-9-17(11-24-19)21-12-19/h1-8,17,21H,9-12H2,(H,22,23)
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n/an/a 662n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330162
PNG
(3-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-4-yl...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H19ClN2O2/c20-15-3-1-2-13(10-15)18(23)22-16-6-4-14(5-7-16)19-9-8-17(11-24-19)21-12-19/h1-7,10,17,21H,8-9,11-12H2,(H,22,23)
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n/an/a 797n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330164
PNG
(1-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)9-19-10-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)/t17-,19-/m0/s1
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n/an/a 846n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330188
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cn1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)14-7-22-15(8-21-14)24-12-3-1-11(2-4-12)5-16-6-13(9-25-16)23-10-16/h1-4,7-8,13,23H,5-6,9-10H2,(H,22,24)/t13-,16-/m0/s1
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n/an/a 854n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330189
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)12-7-21-15(22-8-12)24-13-3-1-11(2-4-13)5-16-6-14(9-25-16)23-10-16/h1-4,7-8,14,23H,5-6,9-10H2,(H,21,22,24)/t14-,16-/m0/s1
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n/an/a 881n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330187
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1ccc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-3-6-16(22-9-13)24-14-4-1-12(2-5-14)7-17-8-15(10-25-17)23-11-17/h1-6,9,15,23H,7-8,10-11H2,(H,22,24)/t15-,17-/m0/s1
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n/an/a 946n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330211
PNG
(3-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-3-1-2-12(8-14)17(22)21-15-6-4-13(5-7-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m1/s1
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n/an/a 964n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330210
PNG
(4-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H17ClN2O2/c19-14-5-1-12(2-6-14)17(22)21-15-7-3-13(4-8-15)18-9-16(10-23-18)20-11-18/h1-8,16,20H,9-11H2,(H,21,22)/t16-,18-/m1/s1
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n/an/a 970n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330182
PNG
(6-Ethoxy-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-5-15(11-21-18)19(24)23-16-6-3-14(4-7-16)9-20-10-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)/t17-,20-/m0/s1
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n/an/a 1.14E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330208
PNG
(3-Isopropyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2....)
Show SMILES CC(C)c1cc([nH]n1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H24N4O2/c1-12(2)16-7-17(23-22-16)18(24)21-14-5-3-13(4-6-14)8-19-9-15(10-25-19)20-11-19/h3-7,12,15,20H,8-11H2,1-2H3,(H,21,24)(H,22,23)/t15-,19-/m1/s1
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n/an/a 1.16E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330167
PNG
((RS)-4-(Cyclopropylmethoxy)-N-[4-(5-oxa-2-azabicyc...)
Show SMILES O=C(Nc1ccc(cc1)C12CCC(CO1)NC2)c1ccc(OCC2CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c26-22(17-3-9-21(10-4-17)27-13-16-1-2-16)25-19-7-5-18(6-8-19)23-12-11-20(14-28-23)24-15-23/h3-10,16,20,24H,1-2,11-15H2,(H,25,26)
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n/an/a 1.22E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330206
PNG
(2-Ethyl-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES CCc1ncc(cn1)C(=O)Nc1ccc(C[C@@]23CN[C@@H](CO2)C3)cc1
Show InChI InChI=1S/C19H22N4O2/c1-2-17-20-9-14(10-21-17)18(24)23-15-5-3-13(4-6-15)7-19-8-16(11-25-19)22-12-19/h3-6,9-10,16,22H,2,7-8,11-12H2,1H3,(H,23,24)/t16-,19-/m1/s1
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n/an/a 1.25E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330158
PNG
(1-(3-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1cccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-2-1-3-16(8-14)23-18(24)22-15-6-4-13(5-7-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m0/s1
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n/an/a 1.35E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330193
PNG
((RS)—N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-y...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)16-9-12(6-8-23-16)17(26)25-14-3-1-13(2-4-14)18-7-5-15(10-27-18)24-11-18/h1-4,6,8-9,15,24H,5,7,10-11H2,(H,25,26)
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n/an/a 1.44E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330184
PNG
(2-Cyclopropyl-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2....)
Show SMILES O=C(Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(15-9-21-18(22-10-15)14-3-4-14)24-16-5-1-13(2-6-16)7-20-8-17(11-26-20)23-12-20/h1-2,5-6,9-10,14,17,23H,3-4,7-8,11-12H2,(H,24,25)/t17-,20-/m0/s1
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n/an/a 1.58E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330165
PNG
(1-(2-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccccc1NC(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-16-3-1-2-4-17(16)23-18(24)22-14-7-5-13(6-8-14)9-19-10-15(11-25-19)21-12-19/h1-8,15,21H,9-12H2,(H2,22,23,24)/t15-,19-/m0/s1
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n/an/a 1.63E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330176
PNG
(5-Chloro-N-[4-[(1R,4S)-5-oxa-2-azabicyclo[2.2.1]he...)
Show SMILES Clc1ccc(Nc2ccc(cc2)[C@@]23CN[C@@H](CO2)C3)nc1
Show InChI InChI=1S/C16H16ClN3O/c17-12-3-6-15(18-8-12)20-13-4-1-11(2-5-13)16-7-14(9-21-16)19-10-16/h1-6,8,14,19H,7,9-10H2,(H,18,20)/t14-,16-/m1/s1
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n/an/a 1.78E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330068
PNG
(1-(4-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m0/s1
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n/an/a 1.82E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330213
PNG
(N-[4-[(1R,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@@]12CN[C@@H](CO1)C2
Show InChI InChI=1S/C18H16F3N3O2/c19-18(20,21)15-7-11(5-6-22-15)16(25)24-13-3-1-12(2-4-13)17-8-14(9-26-17)23-10-17/h1-7,14,23H,8-10H2,(H,24,25)/t14-,17-/m1/s1
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n/an/a 1.91E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330192
PNG
(N-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phenyl]-...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)C23CCC(CO2)NC3)n1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)15-21-8-6-14(24-15)23-12-3-1-11(2-4-12)16-7-5-13(9-25-16)22-10-16/h1-4,6,8,13,22H,5,7,9-10H2,(H,21,23,24)
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n/an/a 1.97E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330209
PNG
(4-Ethoxy-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-4-yl...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C21H24N2O3/c1-2-25-19-9-3-15(4-10-19)20(24)23-17-7-5-16(6-8-17)21-12-11-18(13-26-21)22-14-21/h3-10,18,22H,2,11-14H2,1H3,(H,23,24)
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US Patent
n/an/a 1.98E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330212
PNG
(N-[4-[(1R,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-yl...)
Show SMILES FC(F)(F)c1nccc(Nc2ccc(cc2)[C@@]23CN[C@@H](CO2)C3)n1
Show InChI InChI=1S/C16H15F3N4O/c17-16(18,19)14-20-6-5-13(23-14)22-11-3-1-10(2-4-11)15-7-12(8-24-15)21-9-15/h1-6,12,21H,7-9H2,(H,20,22,23)/t12-,15-/m1/s1
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US Patent
n/an/a 2.41E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330159
PNG
((RS)-5-Chloro-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES Clc1ccc(Nc2ccc(cc2)C23CCC(CO2)NC3)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)17-8-7-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)
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US Patent
n/an/a 2.46E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330186
PNG
(5-Chloro-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m0/s1
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n/an/a 2.55E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330221
PNG
(US9663530, Example 65)
Show SMILES Clc1ccc(Nc2ccc(C[C@]34CCC(CO3)NC4)cc2)nc1
Show InChI InChI=1S/C18H20ClN3O/c19-14-3-6-17(20-10-14)22-15-4-1-13(2-5-15)9-18-8-7-16(11-23-18)21-12-18/h1-6,10,16,21H,7-9,11-12H2,(H,20,22)/t16?,18-/m0/s1
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US Patent
n/an/a 3.84E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330189
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)12-7-21-15(22-8-12)24-13-3-1-11(2-4-13)5-16-6-14(9-25-16)23-10-16/h1-4,7-8,14,23H,5-6,9-10H2,(H,21,22,24)/t14-,16-/m0/s1
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n/an/a 5.80E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330168
PNG
((RS)-6-Ethoxy-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan...)
Show SMILES CCOc1ccc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C20H23N3O3/c1-2-25-18-8-3-14(11-21-18)19(24)23-16-6-4-15(5-7-16)20-10-9-17(12-26-20)22-13-20/h3-8,11,17,22H,2,9-10,12-13H2,1H3,(H,23,24)
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n/an/a 7.06E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330198
PNG
(5-Chloro-N-[4-[[(1R,4R)-5-oxa-2-azabicyclo[2.2.1]h...)
Show SMILES Clc1ccc(Nc2ccc(C[C@@]34CN[C@@H](CO3)C4)cc2)nc1
Show InChI InChI=1S/C17H18ClN3O/c18-13-3-6-16(19-9-13)21-14-4-1-12(2-5-14)7-17-8-15(10-22-17)20-11-17/h1-6,9,15,20H,7-8,10-11H2,(H,19,21)/t15-,17-/m1/s1
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n/an/a 7.68E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330188
PNG
(N-[4-[[(1S,4S)-5-Oxa-2-azabicyclo[2.2.1]heptan-4-y...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cn1
Show InChI InChI=1S/C17H17F3N4O/c18-17(19,20)14-7-22-15(8-21-14)24-12-3-1-11(2-4-12)5-16-6-13(9-25-16)23-10-16/h1-4,7-8,13,23H,5-6,9-10H2,(H,22,24)/t13-,16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330170
PNG
((RS)-2-Cyclopropyl-N-[4-(5-oxa-2-azabicyclo[2.2.2]...)
Show SMILES O=C(Nc1ccc(cc1)C12CCC(CO1)NC2)c1cnc(nc1)C1CC1
Show InChI InChI=1S/C20H22N4O2/c25-19(14-9-21-18(22-10-14)13-1-2-13)24-16-5-3-15(4-6-16)20-8-7-17(11-26-20)23-12-20/h3-6,9-10,13,17,23H,1-2,7-8,11-12H2,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330191
PNG
((RS)-2-Ethyl-N-[4-(5-oxa-2-azabicyclo[2.2.2]octan-...)
Show SMILES CCc1ncc(cn1)C(=O)Nc1ccc(cc1)C12CCC(CO1)NC2
Show InChI InChI=1S/C19H22N4O2/c1-2-17-20-9-13(10-21-17)18(24)23-15-5-3-14(4-6-15)19-8-7-16(11-25-19)22-12-19/h3-6,9-10,16,22H,2,7-8,11-12H2,1H3,(H,23,24)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM330194
PNG
(3-Isopropyl-N-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2....)
Show SMILES CC(C)c1cc([nH]n1)C(=O)Nc1ccc(C[C@]23CN[C@H](CO2)C3)cc1
Show InChI InChI=1S/C19H24N4O2/c1-12(2)16-7-17(23-22-16)18(24)21-14-5-3-13(4-6-14)8-19-9-15(10-25-19)20-11-19/h3-7,12,15,20H,8-11H2,1-2H3,(H,21,24)(H,22,23)/t15-,19-/m0/s1
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n/an/a 1.01E+4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing rat TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat in...


US Patent US9663530 (2017)

More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM330068
PNG
(1-(4-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...)
Show SMILES Clc1ccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-14-3-7-16(8-4-14)23-18(24)22-15-5-1-13(2-6-15)9-19-10-17(11-25-19)21-12-19/h1-8,17,21H,9-12H2,(H2,22,23,24)/t17-,19-/m0/s1
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n/an/a 1.15E+6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HEK-293 cells stably expressing mouse TAAR1 were maintained at 37 C. and 5% CO2 in DMEM high glucose medium, containing fetal calf serum (10%, heat ...


US Patent US9663530 (2017)

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