Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Trace amine-associated receptor 1' and Ligand = 'BDBM330221'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM330221 (US9663530, Example 65) Show SMILES Clc1ccc(Nc2ccc(C[C@]34CCC(CO3)NC4)cc2)nc1 |r| Show InChI InChI=1S/C18H20ClN3O/c19-14-3-6-17(20-10-14)22-15-4-1-13(2-5-15)9-18-8-7-16(11-23-18)21-12-18/h1-6,10,16,21H,7-9,11-12H2,(H,20,22)/t16?,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	122	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
Trace amine-associated receptor 1 (Rattus norvegicus (Rat))	BDBM330221 (US9663530, Example 65) Show SMILES Clc1ccc(Nc2ccc(C[C@]34CCC(CO3)NC4)cc2)nc1 |r| Show InChI InChI=1S/C18H20ClN3O/c19-14-3-6-17(20-10-14)22-15-4-1-13(2-5-15)9-18-8-7-16(11-23-18)21-12-18/h1-6,10,16,21H,7-9,11-12H2,(H,20,22)/t16?,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.84E+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