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Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with Target = 'Trace amine-associated receptor 1' and Ligand = 'BDBM50359500'   
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


(Homo sapiens (Human))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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PubMed
n/an/an/an/a 3.30E+3n/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Activation of C-terminal HA epitope tagged human TAAR1 expressed in RD-HGA16 cells co-expressing Gq protein, Galpha16 by cAMP accumulation assay


Bioorg Med Chem 19: 7044-8 (2011)


Article DOI: 10.1016/j.bmc.2011.10.007
BindingDB Entry DOI: 10.7270/Q2765FR0
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Macaca mulatta)
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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PubMed
n/an/an/an/a 2.50E+3n/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Activation of rhesus monkey TAAR1 expressed in RD-HGA16 cells co-expressing Gq protein assessed as cAMP accumulation by fluorescence plate reader


Bioorg Med Chem 19: 7044-8 (2011)


Article DOI: 10.1016/j.bmc.2011.10.007
BindingDB Entry DOI: 10.7270/Q2765FR0
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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n/an/an/an/a 1.19E+3n/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Activation of rat TAAR1 expressed in HEK293 cells assessed as accumulation of [3H]cAMP after 1 hr by liquid scintillation counting


Bioorg Med Chem 19: 7044-8 (2011)


Article DOI: 10.1016/j.bmc.2011.10.007
BindingDB Entry DOI: 10.7270/Q2765FR0
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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PubMed
n/an/an/an/a 2.44E+3n/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Activation of mouse TAAR1 expressed in human HEK293 cells assessed as accumulation of [3H]cAMP after 1 hr by liquid scintillation counting


Bioorg Med Chem 19: 7044-8 (2011)


Article DOI: 10.1016/j.bmc.2011.10.007
BindingDB Entry DOI: 10.7270/Q2765FR0
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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n/an/an/an/a 1.60E+3n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of mouse TAAR1 transmembrane domain 7 Tyr287(7.39)Asn mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 ...


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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PubMed
n/an/an/an/a 233n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of rat wild type TAAR1 expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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Article
PubMed
n/an/an/an/a 330n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of rat TAAR1 transmembrane domain 7 Asn287(7.39)Tyr mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr...


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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PubMed
n/an/an/an/a 126n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of mouse TAAR1 transmembrane domain 6 Thr268(6.55)Met mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 ...


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Mus musculus (Mouse))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
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Article
PubMed
n/an/an/an/a 843n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of mouse wild type TAAR1 expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1


(Rattus norvegicus (Rat))
BDBM50359500
PNG
((R)Methamphetamine | CHEMBL1927030)
Show SMILES CN[C@H](C)Cc1ccccc1 |r|
Show InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1
PDB

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Article
PubMed
n/an/an/an/a 1.11E+3n/an/an/an/a



Oregon Health & Science University

Curated by ChEMBL


Assay Description
Activation of rat TAAR1 transmembrane domain 6 Met268(6.55)Thr mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr...


J Med Chem 57: 378-90 (2014)


Article DOI: 10.1021/jm401316v
BindingDB Entry DOI: 10.7270/Q2BC42HK
More data for this
Ligand-Target Pair