BDBM330223 (RS)-1-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phenyl]-3-[4-(trifluoromethyl)phenyl]urea::US9663530, Example 67

SMILES: FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1

InChI Key: InChIKey=DZIMZTRBPKPCRV-UHFFFAOYSA-N

Data: 2 IC50

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 = 330223   

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 (Rattus norvegicus (Rat))	BDBM330223 ((RS)-1-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phe...) Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1 Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)19-10-9-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	26.3	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 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 (Mus musculus (Mouse))	BDBM330223 ((RS)-1-[4-(5-Oxa-2-azabicyclo[2.2.2]octan-4-yl)phe...) Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C23CCC(CO2)NC3)cc1 Show InChI InChI=1S/C20H20F3N3O2/c21-20(22,23)14-3-7-16(8-4-14)26-18(27)25-15-5-1-13(2-6-15)19-10-9-17(11-28-19)24-12-19/h1-8,17,24H,9-12H2,(H2,25,26,27)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13.7	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