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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 119186   
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)


(Rattus norvegicus (Rat))
BDBM119186
PNG
(US8673950, 53)
Show SMILES CCC(=O)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1
Show InChI InChI=1S/C18H21N5O2/c1-2-16(24)13-9-20-18(21-10-13)23-14-6-3-12(4-7-14)5-8-15-11-25-17(19)22-15/h3-4,6-7,9-10,15H,2,5,8,11H2,1H3,(H2,19,22)(H,20,21,23)/t15-/m0/s1
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

US Patent
26.5n/an/an/an/an/an/an/an/a



Hoffmann-La Roche Inc

US Patent


Assay Description
The TAAR1 radioligand 3[H]-(S)-4-[(ethyl-phenyl-amino)-methyl]-4,5-dihydro-oxazol-2-ylamine (described in WO 2008/098857) was used at a concentration...


US Patent US8673950 (2014)


BindingDB Entry DOI: 10.7270/Q29S1PQD
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Mus musculus (Mouse))
BDBM119186
PNG
(US8673950, 53)
Show SMILES CCC(=O)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1
Show InChI InChI=1S/C18H21N5O2/c1-2-16(24)13-9-20-18(21-10-13)23-14-6-3-12(4-7-14)5-8-15-11-25-17(19)22-15/h3-4,6-7,9-10,15H,2,5,8,11H2,1H3,(H2,19,22)(H,20,21,23)/t15-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
113n/an/an/an/an/an/an/an/a



Hoffmann-La Roche Inc

US Patent


Assay Description
The TAAR1 radioligand 3[H]-(S)-4-[(ethyl-phenyl-amino)-methyl]-4,5-dihydro-oxazol-2-ylamine (described in WO 2008/098857) was used at a concentration...


US Patent US8673950 (2014)


BindingDB Entry DOI: 10.7270/Q29S1PQD
More data for this
Ligand-Target Pair