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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Trace amine-associated receptor 1' and Ligand = 'BDBM50181826'   
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


(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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KEGG

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
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
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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