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PubMed code 16451074

Compile data set for download or QSAR
Found 76 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


(Rattus norvegicus (Rat))		BDBM50181803
PNG
(3,3',5,5'-tetraiodothyronamine | CHEMBL201623)
Show SMILES NCCc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H11I4NO2/c15-9-5-8(6-10(16)13(9)20)21-14-11(17)3-7(1-2-19)4-12(14)18/h3-6,20H,1-2,19H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181809
PNG
(CHEMBL202279 | N-methyl-O-benzyl-tyramine)
Show SMILES CNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H19NO/c1-17-12-11-14-7-9-16(10-8-14)18-13-15-5-3-2-4-6-15/h2-10,17H,11-13H2,1H3
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n/an/an/an/a 54n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181823
PNG
(CHEMBL425035 | O-phenyl-3-iodotyramine)
Show SMILES NCCc1ccc(Oc2ccccc2)c(I)c1
Show InChI InChI=1S/C14H14INO/c15-13-10-11(8-9-16)6-7-14(13)17-12-4-2-1-3-5-12/h1-7,10H,8-9,16H2
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n/an/an/an/a 35n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181824
PNG
(3,3'-Diiodothyronamine | CHEMBL383495)
Show SMILES NCCc1ccc(Oc2ccc(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H13I2NO2/c15-11-8-10(2-3-13(11)18)19-14-4-1-9(5-6-17)7-12(14)16/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a 1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181824
PNG
(3,3'-Diiodothyronamine | CHEMBL383495)
Show SMILES NCCc1ccc(Oc2ccc(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H13I2NO2/c15-11-8-10(2-3-13(11)18)19-14-4-1-9(5-6-17)7-12(14)16/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a 41n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181810
PNG
(CHEMBL202183 | O-(m-methoxy)benzyl-tyramine)
Show SMILES COc1cccc(COc2ccc(CCN)cc2)c1
Show InChI InChI=1S/C16H19NO2/c1-18-16-4-2-3-14(11-16)12-19-15-7-5-13(6-8-15)9-10-17/h2-8,11H,9-10,12,17H2,1H3
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n/an/an/an/a 194n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181814
PNG
(CHEMBL201993 | O-(p-nitro)benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H16N2O3/c16-10-9-12-3-7-15(8-4-12)20-11-13-1-5-14(6-2-13)17(18)19/h1-8H,9-11,16H2
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n/an/an/an/a 64n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181795
PNG
(CHEMBL200088 | O-benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C15H17NO/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h1-9H,10-12,16H2
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n/an/an/an/a 168n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181792
PNG
(3-methyl-thyronamine | CHEMBL202457)
Show SMILES Cc1cc(CCN)ccc1Oc1ccc(O)cc1
Show InChI InChI=1S/C15H17NO2/c1-11-10-12(8-9-16)2-7-15(11)18-14-5-3-13(17)4-6-14/h2-7,10,17H,8-9,16H2,1H3
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n/an/an/an/a 33n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181793
PNG
(CHEMBL202548 | O-(m,m-dimethoxy)benzyl-tyramine)
Show SMILES COc1cc(COc2ccc(CCN)cc2)cc(OC)c1
Show InChI InChI=1S/C17H21NO3/c1-19-16-9-14(10-17(11-16)20-2)12-21-15-5-3-13(4-6-15)7-8-18/h3-6,9-11H,7-8,12,18H2,1-2H3
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n/an/an/an/a 333n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181796
PNG
(3,5-Diiodothyronamine | CHEMBL201922)
Show SMILES NCCc1cc(I)c(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C14H13I2NO2/c15-12-7-9(5-6-17)8-13(16)14(12)19-11-3-1-10(18)2-4-11/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a 56n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181796
PNG
(3,5-Diiodothyronamine | CHEMBL201922)
Show SMILES NCCc1cc(I)c(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C14H13I2NO2/c15-12-7-9(5-6-17)8-13(16)14(12)19-11-3-1-10(18)2-4-11/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a 371n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181799
PNG
(CHEMBL201892 | O-benzyl-3-iodotyramine)
Show SMILES NCCc1ccc(OCc2ccccc2)c(I)c1
Show InChI InChI=1S/C15H16INO/c16-14-10-12(8-9-17)6-7-15(14)18-11-13-4-2-1-3-5-13/h1-7,10H,8-9,11,17H2
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n/an/an/an/a 77n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181802
PNG
(CHEMBL202024 | N-methyl-3-iodothyronamine)
Show SMILES CNCCc1ccc(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C15H16INO2/c1-17-9-8-11-2-7-15(14(16)10-11)19-13-5-3-12(18)4-6-13/h2-7,10,17-18H,8-9H2,1H3
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n/an/an/an/a 18n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181810
PNG
(CHEMBL202183 | O-(m-methoxy)benzyl-tyramine)
Show SMILES COc1cccc(COc2ccc(CCN)cc2)c1
Show InChI InChI=1S/C16H19NO2/c1-18-16-4-2-3-14(11-16)12-19-15-7-5-13(6-8-15)9-10-17/h2-8,11H,9-10,12,17H2,1H3
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n/an/an/an/a 141n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181792
PNG
(3-methyl-thyronamine | CHEMBL202457)
Show SMILES Cc1cc(CCN)ccc1Oc1ccc(O)cc1
Show InChI InChI=1S/C15H17NO2/c1-11-10-12(8-9-16)2-7-15(11)18-14-5-3-13(17)4-6-14/h2-7,10,17H,8-9,16H2,1H3
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n/an/an/an/a 116n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181815
PNG
(2-[3-iodo-4-(p-hydroxy)phenoxyphenyl]ethanol | CHE...)
Show SMILES OCCc1ccc(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C14H13IO3/c15-13-9-10(7-8-16)1-6-14(13)18-12-4-2-11(17)3-5-12/h1-6,9,16-17H,7-8H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181793
PNG
(CHEMBL202548 | O-(m,m-dimethoxy)benzyl-tyramine)
Show SMILES COc1cc(COc2ccc(CCN)cc2)cc(OC)c1
Show InChI InChI=1S/C17H21NO3/c1-19-16-9-14(10-17(11-16)20-2)12-21-15-5-3-13(4-6-15)7-8-18/h3-6,9-11H,7-8,12,18H2,1-2H3
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n/an/an/an/a 123n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181811
PNG
(CHEMBL381288 | O-(3'-phenyl)propyl-tyramine)
Show SMILES NCCc1ccc(OCCCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c18-13-12-16-8-10-17(11-9-16)19-14-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14,18H2
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n/an/an/an/a 89n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181817
PNG
(3,3',5'-triiodothyronamine | CHEMBL381531)
Show SMILES NCCc1ccc(Oc2cc(I)c(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H12I3NO2/c15-10-5-8(3-4-18)1-2-13(10)20-9-6-11(16)14(19)12(17)7-9/h1-2,5-7,19H,3-4,18H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181826
PNG
(CHEMBL202021 | O-(p-trifluromethyl)phenyl-3-iodoty...)
Show SMILES CNCCc1ccc(Oc2ccc(cc2)C(F)(F)F)c(I)c1
Show InChI InChI=1S/C16H15F3INO/c1-21-9-8-11-2-7-15(14(20)10-11)22-13-5-3-12(4-6-13)16(17,18)19/h2-7,10,21H,8-9H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181819
PNG
(CHEMBL371324 | N-propyl-O-benzyl-tyramine)
Show SMILES CCCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C18H23NO/c1-2-13-19-14-12-16-8-10-18(11-9-16)20-15-17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181805
PNG
(3',5'-diiodothyronamine | CHEMBL201001)
Show SMILES NCCc1ccc(Oc2cc(I)c(O)c(I)c2)cc1
Show InChI InChI=1S/C14H13I2NO2/c15-12-7-11(8-13(16)14(12)18)19-10-3-1-9(2-4-10)5-6-17/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181816
PNG
(3,3',5-triiodothyronamine | CHEMBL201885)
Show SMILES NCCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H12I3NO2/c15-10-7-9(1-2-13(10)19)20-14-11(16)5-8(3-4-18)6-12(14)17/h1-2,5-7,19H,3-4,18H2
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n/an/an/an/a 87n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181807
PNG
(CHEMBL202172 | O-(2',3',4',5',6'-pentafluoro)benzy...)
Show SMILES NCCc1ccc(OCc2c(F)c(F)c(F)c(F)c2F)cc1
Show InChI InChI=1S/C15H12F5NO/c16-11-10(12(17)14(19)15(20)13(11)18)7-22-9-3-1-8(2-4-9)5-6-21/h1-4H,5-7,21H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181820
PNG
(CHEMBL202046 | N-butyl-O-benzyl-tyramine)
Show SMILES CCCCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C19H25NO/c1-2-3-14-20-15-13-17-9-11-19(12-10-17)21-16-18-7-5-4-6-8-18/h4-12,20H,2-3,13-16H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181813
PNG
(CHEMBL201864 | O-(p-fluoro)benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccc(F)cc2)cc1
Show InChI InChI=1S/C15H16FNO/c16-14-5-1-13(2-6-14)11-18-15-7-3-12(4-8-15)9-10-17/h1-8H,9-11,17H2
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n/an/an/an/a 38.5n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181825
PNG
(2-(4-Phenoxy-phenyl)-ethylamine | CHEMBL312689 | O...)
Show SMILES NCCc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C14H15NO/c15-11-10-12-6-8-14(9-7-12)16-13-4-2-1-3-5-13/h1-9H,10-11,15H2
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n/an/an/an/a 296n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181823
PNG
(CHEMBL425035 | O-phenyl-3-iodotyramine)
Show SMILES NCCc1ccc(Oc2ccccc2)c(I)c1
Show InChI InChI=1S/C14H14INO/c15-13-10-11(8-9-16)6-7-14(13)17-12-4-2-1-3-5-12/h1-7,10H,8-9,16H2
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n/an/an/an/a 2.40n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181803
PNG
(3,3',5,5'-tetraiodothyronamine | CHEMBL201623)
Show SMILES NCCc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H11I4NO2/c15-9-5-8(6-10(16)13(9)20)21-14-11(17)3-7(1-2-19)4-12(14)18/h3-6,20H,1-2,19H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181804
PNG
(CHEMBL425579 | N,O-dibenzyl-tyramine)
Show SMILES C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccccc1
Show InChI InChI=1S/C22H23NO/c1-3-7-20(8-4-1)17-23-16-15-19-11-13-22(14-12-19)24-18-21-9-5-2-6-10-21/h1-14,23H,15-18H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181821
PNG
(CHEMBL202071 | O-(p-trifluoromethyl)benzyl-tyramin...)
Show SMILES NCCc1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C16H16F3NO/c17-16(18,19)14-5-1-13(2-6-14)11-21-15-7-3-12(4-8-15)9-10-20/h1-8H,9-11,20H2
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n/an/an/an/a 55n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181794
PNG
(CHEMBL425223 | O-(p-trifluoromethyl)benzyl-3-iodot...)
Show SMILES NCCc1ccc(OCc2ccc(cc2)C(F)(F)F)c(I)c1
Show InChI InChI=1S/C16H15F3INO/c17-16(18,19)13-4-1-12(2-5-13)10-22-15-6-3-11(7-8-21)9-14(15)20/h1-6,9H,7-8,10,21H2
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n/an/an/an/a 284n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181814
PNG
(CHEMBL201993 | O-(p-nitro)benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H16N2O3/c16-10-9-12-3-7-15(8-4-12)20-11-13-1-5-14(6-2-13)17(18)19/h1-8H,9-11,16H2
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n/an/an/an/a 21.5n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181811
PNG
(CHEMBL381288 | O-(3'-phenyl)propyl-tyramine)
Show SMILES NCCc1ccc(OCCCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c18-13-12-16-8-10-17(11-9-16)19-14-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14,18H2
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n/an/an/an/a 102n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181812
PNG
(CHEMBL382580 | O-(p-fluoro)phenyl-3-iodotyramine)
Show SMILES CNCCc1ccc(Oc2ccc(F)cc2)c(I)c1
Show InChI InChI=1S/C15H15FINO/c1-18-9-8-11-2-7-15(14(17)10-11)19-13-5-3-12(16)4-6-13/h2-7,10,18H,8-9H2,1H3
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n/an/an/an/a 2.70n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181818
PNG
(CHEMBL202209 | O-(phenylmethanone)methyl-tyramine)
Show SMILES NCCc1ccc(OCC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C16H17NO2/c17-11-10-13-6-8-15(9-7-13)19-12-16(18)14-4-2-1-3-5-14/h1-9H,10-12,17H2
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n/an/an/an/a 83n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181801
PNG
(3'-iodothyronamine | CHEMBL201002)
Show SMILES NCCc1ccc(Oc2ccc(O)c(I)c2)cc1
Show InChI InChI=1S/C14H14INO2/c15-13-9-12(5-6-14(13)17)18-11-3-1-10(2-4-11)7-8-16/h1-6,9,17H,7-8,16H2
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n/an/an/an/a 800n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181816
PNG
(3,3',5-triiodothyronamine | CHEMBL201885)
Show SMILES NCCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H12I3NO2/c15-10-7-9(1-2-13(10)19)20-14-11(16)5-8(3-4-18)6-12(14)17/h1-2,5-7,19H,3-4,18H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181805
PNG
(3',5'-diiodothyronamine | CHEMBL201001)
Show SMILES NCCc1ccc(Oc2cc(I)c(O)c(I)c2)cc1
Show InChI InChI=1S/C14H13I2NO2/c15-12-7-11(8-13(16)14(12)18)19-10-3-1-9(2-4-10)5-6-17/h1-4,7-8,18H,5-6,17H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181797
PNG
(CHEMBL201896 | thyronamine)
Show SMILES NCCc1ccc(Oc2ccc(O)cc2)cc1
Show InChI InChI=1S/C14H15NO2/c15-10-9-11-1-5-13(6-2-11)17-14-7-3-12(16)4-8-14/h1-8,16H,9-10,15H2
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n/an/an/an/a 1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181795
PNG
(CHEMBL200088 | O-benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C15H17NO/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h1-9H,10-12,16H2
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n/an/an/an/a 209n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181794
PNG
(CHEMBL425223 | O-(p-trifluoromethyl)benzyl-3-iodot...)
Show SMILES NCCc1ccc(OCc2ccc(cc2)C(F)(F)F)c(I)c1
Show InChI InChI=1S/C16H15F3INO/c17-16(18,19)13-4-1-12(2-5-13)10-22-15-6-3-11(7-8-21)9-14(15)20/h1-6,9H,7-8,10,21H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181817
PNG
(3,3',5'-triiodothyronamine | CHEMBL381531)
Show SMILES NCCc1ccc(Oc2cc(I)c(O)c(I)c2)c(I)c1
Show InChI InChI=1S/C14H12I3NO2/c15-10-5-8(3-4-18)1-2-13(10)20-9-6-11(16)14(19)12(17)7-9/h1-2,5-7,19H,3-4,18H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181802
PNG
(CHEMBL202024 | N-methyl-3-iodothyronamine)
Show SMILES CNCCc1ccc(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C15H16INO2/c1-17-9-8-11-2-7-15(14(16)10-11)19-13-5-3-12(18)4-6-13/h2-7,10,17-18H,8-9H2,1H3
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n/an/an/an/a 221n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181822
PNG
(CHEMBL202330 | N-ethyl-O-benzyl-tyramine)
Show SMILES CCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c1-2-18-13-12-15-8-10-17(11-9-15)19-14-16-6-4-3-5-7-16/h3-11,18H,2,12-14H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181800
PNG
(CHEMBL201047 | N,N-dimethyl-O-benzyl-tyramine)
Show SMILES CN(C)CCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c1-18(2)13-12-15-8-10-17(11-9-15)19-14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3
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n/an/an/an/a 192n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181806
PNG
(CHEMBL202395 | N,O-dimethyl-3-iodothyronamine)
Show SMILES CNCCc1ccc(Oc2ccc(OC)cc2)c(I)c1
Show InChI InChI=1S/C16H18INO2/c1-18-10-9-12-3-8-16(15(17)11-12)20-14-6-4-13(19-2)5-7-14/h3-8,11,18H,9-10H2,1-2H3
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n/an/an/an/a 107n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181799
PNG
(CHEMBL201892 | O-benzyl-3-iodotyramine)
Show SMILES NCCc1ccc(OCc2ccccc2)c(I)c1
Show InChI InChI=1S/C15H16INO/c16-14-10-12(8-9-17)6-7-15(14)18-11-13-4-2-1-3-5-13/h1-7,10H,8-9,11,17H2
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n/an/an/an/a 221n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181819
PNG
(CHEMBL371324 | N-propyl-O-benzyl-tyramine)
Show SMILES CCCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C18H23NO/c1-2-13-19-14-12-16-8-10-18(11-9-16)20-15-17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181826
PNG
(CHEMBL202021 | O-(p-trifluromethyl)phenyl-3-iodoty...)
Show SMILES CNCCc1ccc(Oc2ccc(cc2)C(F)(F)F)c(I)c1
Show InChI InChI=1S/C16H15F3INO/c1-21-9-8-11-2-7-15(14(20)10-11)22-13-5-3-12(4-6-13)16(17,18)19/h2-7,10,21H,8-9H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181797
PNG
(CHEMBL201896 | thyronamine)
Show SMILES NCCc1ccc(Oc2ccc(O)cc2)cc1
Show InChI InChI=1S/C14H15NO2/c15-10-9-11-1-5-13(6-2-11)17-14-7-3-12(16)4-8-14/h1-8,16H,9-10,15H2
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n/an/an/an/a 131n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181798
PNG
(CHEMBL202335 | N-methyl-O-(p-trifluoromethyl)benzy...)
Show SMILES CNCCc1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C17H18F3NO/c1-21-11-10-13-4-8-16(9-5-13)22-12-14-2-6-15(7-3-14)17(18,19)20/h2-9,21H,10-12H2,1H3
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n/an/an/an/a 61n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181804
PNG
(CHEMBL425579 | N,O-dibenzyl-tyramine)
Show SMILES C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccccc1
Show InChI InChI=1S/C22H23NO/c1-3-7-20(8-4-1)17-23-16-15-19-11-13-22(14-12-19)24-18-21-9-5-2-6-10-21/h1-14,23H,15-18H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181807
PNG
(CHEMBL202172 | O-(2',3',4',5',6'-pentafluoro)benzy...)
Show SMILES NCCc1ccc(OCc2c(F)c(F)c(F)c(F)c2F)cc1
Show InChI InChI=1S/C15H12F5NO/c16-11-10(12(17)14(19)15(20)13(11)18)7-22-9-3-1-8(2-4-9)5-6-21/h1-4H,5-7,21H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181813
PNG
(CHEMBL201864 | O-(p-fluoro)benzyl-tyramine)
Show SMILES NCCc1ccc(OCc2ccc(F)cc2)cc1
Show InChI InChI=1S/C15H16FNO/c16-14-5-1-13(2-6-14)11-18-15-7-3-12(4-8-15)9-10-17/h1-8H,9-11,17H2
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n/an/an/an/a 72n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181827
PNG
(CHEMBL425398 | N-methyl-O-benzyl-3-iodotyramine)
Show SMILES CNCCc1ccc(OCc2ccccc2)c(I)c1
Show InChI InChI=1S/C16H18INO/c1-18-10-9-13-7-8-16(15(17)11-13)19-12-14-5-3-2-4-6-14/h2-8,11,18H,9-10,12H2,1H3
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n/an/an/an/a 68n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181827
PNG
(CHEMBL425398 | N-methyl-O-benzyl-3-iodotyramine)
Show SMILES CNCCc1ccc(OCc2ccccc2)c(I)c1
Show InChI InChI=1S/C16H18INO/c1-18-10-9-13-7-8-16(15(17)11-13)19-12-14-5-3-2-4-6-14/h2-8,11,18H,9-10,12H2,1H3
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n/an/an/an/a 106n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181820
PNG
(CHEMBL202046 | N-butyl-O-benzyl-tyramine)
Show SMILES CCCCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C19H25NO/c1-2-3-14-20-15-13-17-9-11-19(12-10-17)21-16-18-7-5-4-6-8-18/h4-12,20H,2-3,13-16H2,1H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181828
PNG
(CHEMBL202047 | O-(2'-phenyl)ethyl-tyramine)
Show SMILES NCCc1ccc(OCCc2ccccc2)cc1
Show InChI InChI=1S/C16H19NO/c17-12-10-15-6-8-16(9-7-15)18-13-11-14-4-2-1-3-5-14/h1-9H,10-13,17H2
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n/an/an/an/a 207n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181825
PNG
(2-(4-Phenoxy-phenyl)-ethylamine | CHEMBL312689 | O...)
Show SMILES NCCc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C14H15NO/c15-11-10-12-6-8-14(9-7-12)16-13-4-2-1-3-5-13/h1-9H,10-11,15H2
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n/an/an/an/a 38n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181822
PNG
(CHEMBL202330 | N-ethyl-O-benzyl-tyramine)
Show SMILES CCNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c1-2-18-13-12-15-8-10-17(11-9-15)19-14-16-6-4-3-5-7-16/h3-11,18H,2,12-14H2,1H3
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n/an/an/an/a 71n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181818
PNG
(CHEMBL202209 | O-(phenylmethanone)methyl-tyramine)
Show SMILES NCCc1ccc(OCC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C16H17NO2/c17-11-10-13-6-8-15(9-7-13)19-12-16(18)14-4-2-1-3-5-14/h1-9H,10-12,17H2
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n/an/an/an/a 309n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181798
PNG
(CHEMBL202335 | N-methyl-O-(p-trifluoromethyl)benzy...)
Show SMILES CNCCc1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C17H18F3NO/c1-21-11-10-13-4-8-16(9-5-13)22-12-14-2-6-15(7-3-14)17(18,19)20/h2-9,21H,10-12H2,1H3
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n/an/an/an/a 12n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181800
PNG
(CHEMBL201047 | N,N-dimethyl-O-benzyl-tyramine)
Show SMILES CN(C)CCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H21NO/c1-18(2)13-12-15-8-10-17(11-9-15)19-14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181801
PNG
(3'-iodothyronamine | CHEMBL201002)
Show SMILES NCCc1ccc(Oc2ccc(O)c(I)c2)cc1
Show InChI InChI=1S/C14H14INO2/c15-13-9-12(5-6-14(13)17)18-11-3-1-10(2-4-11)7-8-16/h1-6,9,17H,7-8,16H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181806
PNG
(CHEMBL202395 | N,O-dimethyl-3-iodothyronamine)
Show SMILES CNCCc1ccc(Oc2ccc(OC)cc2)c(I)c1
Show InChI InChI=1S/C16H18INO2/c1-18-10-9-12-3-8-16(15(17)11-12)20-14-6-4-13(19-2)5-7-14/h3-8,11,18H,9-10H2,1-2H3
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181808
PNG
(CHEMBL202099 | O-(4'-phenyl)butyl-tyramine)
Show SMILES NCCc1ccc(OCCCCc2ccccc2)cc1
Show InChI InChI=1S/C18H23NO/c19-14-13-17-9-11-18(12-10-17)20-15-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8,13-15,19H2
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n/an/an/an/a 80n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181821
PNG
(CHEMBL202071 | O-(p-trifluoromethyl)benzyl-tyramin...)
Show SMILES NCCc1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C16H16F3NO/c17-16(18,19)14-5-1-13(2-6-14)11-21-15-7-3-12(4-8-15)9-10-20/h1-8H,9-11,20H2
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n/an/an/an/a 20.2n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181808
PNG
(CHEMBL202099 | O-(4'-phenyl)butyl-tyramine)
Show SMILES NCCc1ccc(OCCCCc2ccccc2)cc1
Show InChI InChI=1S/C18H23NO/c19-14-13-17-9-11-18(12-10-17)20-15-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8,13-15,19H2
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n/an/an/an/a 43n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181815
PNG
(2-[3-iodo-4-(p-hydroxy)phenoxyphenyl]ethanol | CHE...)
Show SMILES OCCc1ccc(Oc2ccc(O)cc2)c(I)c1
Show InChI InChI=1S/C14H13IO3/c15-13-9-10(7-8-16)1-6-14(13)18-12-4-2-11(17)3-5-12/h1-6,9,16-17H,7-8H2
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181828
PNG
(CHEMBL202047 | O-(2'-phenyl)ethyl-tyramine)
Show SMILES NCCc1ccc(OCCc2ccccc2)cc1
Show InChI InChI=1S/C16H19NO/c17-12-10-15-6-8-16(9-7-15)18-13-11-14-4-2-1-3-5-14/h1-9H,10-13,17H2
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n/an/an/an/a 203n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181829
PNG
(CHEMBL201965 | O-(m,m-dimethyl)benzyl-tyramine)
Show SMILES Cc1cc(C)cc(COc2ccc(CCN)cc2)c1
Show InChI InChI=1S/C17H21NO/c1-13-9-14(2)11-16(10-13)12-19-17-5-3-15(4-6-17)7-8-18/h3-6,9-11H,7-8,12,18H2,1-2H3
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n/an/an/an/a 137n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181829
PNG
(CHEMBL201965 | O-(m,m-dimethyl)benzyl-tyramine)
Show SMILES Cc1cc(C)cc(COc2ccc(CCN)cc2)c1
Show InChI InChI=1S/C17H21NO/c1-13-9-14(2)11-16(10-13)12-19-17-5-3-15(4-6-17)7-8-18/h3-6,9-11H,7-8,12,18H2,1-2H3
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n/an/an/an/a 98n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))		BDBM50181809
PNG
(CHEMBL202279 | N-methyl-O-benzyl-tyramine)
Show SMILES CNCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H19NO/c1-17-12-11-14-7-9-16(10-8-14)18-13-15-5-3-2-4-6-15/h2-10,17H,11-13H2,1H3
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n/an/an/an/a 119n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at rat TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))		BDBM50181812
PNG
(CHEMBL382580 | O-(p-fluoro)phenyl-3-iodotyramine)
Show SMILES CNCCc1ccc(Oc2ccc(F)cc2)c(I)c1
Show InChI InChI=1S/C15H15FINO/c1-18-9-8-11-2-7-15(14(17)10-11)19-13-5-3-12(16)4-6-13/h2-7,10,18H,8-9H2,1H3
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n/an/an/an/a 32.5n/an/an/an/a



University of California at San Francisco

Curated by ChEMBL


Assay Description
Activity at mouse TAAR1 by measuring cAMP accumulation in HEK293 cells

J Med Chem 49: 1101-12 (2006)


Article DOI: 10.1021/jm0505718
BindingDB Entry DOI: 10.7270/Q2416WNR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%