BDBM330158 1-(3-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyclo[2.2.1]heptan-4-yl]methyl]phenyl]urea::US9663530, Example 2
SMILES: Clc1cccc(NC(=O)Nc2ccc(C[C@]34CN[C@H](CO3)C4)cc2)c1
InChI Key: InChIKey=SKPHJRZZTQFFDR-HKUYNNGSSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Trace amine-associated receptor 1 (TAAR1) (Rattus norvegicus (Rat)) | BDBM330158 (1-(3-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | n/a | n/a | 82.2 | n/a | n/a | n/a | n/a | n/a | n/a |
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 ... | US Patent US9663530 (2017) BindingDB Entry DOI: 10.7270/Q2VX0JMC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Trace amine-associated receptor 1 (TAAR1) (Mus musculus (Mouse)) | BDBM330158 (1-(3-Chlorophenyl)-3-[4-[[(1S,4S)-5-oxa-2-azabicyc...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | n/a | n/a | 1.35E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
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 in... | US Patent US9663530 (2017) BindingDB Entry DOI: 10.7270/Q2VX0JMC | |||||||||||
More data for this Ligand-Target Pair |