BindingDB logo
myBDB logout

BDBM129380 US8802673, 22

SMILES: Cc1ccc(CNc2ccc(cc2)[C@H]2CNCCO2)cc1

InChI Key: InChIKey=OKOMODXWXGMTLA-LGWFVXIRNA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 129380   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM129380
PNG
(US8802673, 22)
Show SMILES Cc1ccc(CNc2ccc(cc2)[C@H]2CNCCO2)cc1
Show InChI InChI=1/C18H22N2O/c1-14-2-4-15(5-3-14)12-20-17-8-6-16(7-9-17)18-13-19-10-11-21-18/h2-9,18-20H,10-13H2,1H3/t18-/s2
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
37.5 -10.5n/an/an/an/an/a7.437



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 ina...


US Patent US8802673 (2014)


BindingDB Entry DOI: 10.7270/Q2348J2G
More data for this
Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1)


(Rattus norvegicus (Rat))
BDBM129380
PNG
(US8802673, 22)
Show SMILES Cc1ccc(CNc2ccc(cc2)[C@H]2CNCCO2)cc1
Show InChI InChI=1/C18H22N2O/c1-14-2-4-15(5-3-14)12-20-17-8-6-16(7-9-17)18-13-19-10-11-21-18/h2-9,18-20H,10-13H2,1H3/t18-/s2
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
468 -8.98n/an/an/an/an/a7.437



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 i...


US Patent US8802673 (2014)


BindingDB Entry DOI: 10.7270/Q2348J2G
More data for this
Ligand-Target Pair