BDBM348641 1-[3-[(1R,3S,4R)-2-Oxa-5-azabicyclo[2.2.1]heptan-3-yl]phenyl]-3-[4-(trifluoromethyl)phenyl]urea::US9790230, Example 3

SMILES: FC(F)(F)c1ccc(NC(=O)Nc2cccc(c2)[C@@H]2O[C@H]3CN[C@@H]2C3)cc1

InChI Key: InChIKey=ZNELJINCYKHWAC-ZACQAIPSSA-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 = 348641   

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))	BDBM348641 (1-[3-[(1R,3S,4R)-2-Oxa-5-azabicyclo[2.2.1]heptan-3...) Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2cccc(c2)[C@@H]2O[C@H]3CN[C@@H]2C3)cc1 |r| Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)12-4-6-13(7-5-12)24-18(26)25-14-3-1-2-11(8-14)17-16-9-15(27-17)10-23-16/h1-8,15-17,23H,9-10H2,(H2,24,25,26)/t15-,16-,17+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	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 US9790230 (2017) BindingDB Entry DOI: 10.7270/Q2XG9T8R
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (TAAR1) (Mus musculus (Mouse))	BDBM348641 (1-[3-[(1R,3S,4R)-2-Oxa-5-azabicyclo[2.2.1]heptan-3...) Show SMILES FC(F)(F)c1ccc(NC(=O)Nc2cccc(c2)[C@@H]2O[C@H]3CN[C@@H]2C3)cc1 |r| Show InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)12-4-6-13(7-5-12)24-18(26)25-14-3-1-2-11(8-14)17-16-9-15(27-17)10-23-16/h1-8,15-17,23H,9-10H2,(H2,24,25,26)/t15-,16-,17+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	986	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 US9790230 (2017) BindingDB Entry DOI: 10.7270/Q2XG9T8R
					More data for this Ligand-Target Pair