Compile Data Set for Download or QSAR

Found 97 hits Enz. Inhib. hit(s) with all data for entry = 6311   

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))	BDBM122323 (US8729113, 35) Show SMILES NC1=N[C@@H](CCOc2cccc(Br)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H13BrN2O2/c12-8-2-1-3-10(6-8)15-5-4-9-7-16-11(13)14-9/h1-3,6,9H,4-5,7H2,(H2,13,14)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.100	-53.1	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122301 (US8729113, 8) Show SMILES NC1=N[C@@H](CCOc2ccc(F)c(Cl)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H12ClFN2O2/c12-9-5-8(1-2-10(9)13)16-4-3-7-6-17-11(14)15-7/h1-2,5,7H,3-4,6H2,(H2,14,15)/t7-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.200	-51.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122298 (US8729113, 5) Show SMILES NC1=N[C@@H](CCOc2cccc(Cl)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H13ClN2O2/c12-8-2-1-3-10(6-8)15-5-4-9-7-16-11(13)14-9/h1-3,6,9H,4-5,7H2,(H2,13,14)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.300	-50.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122333 (US8729113, 57) Show SMILES NC1=N[C@@H](CCOc2ccc(Cl)c(Cl)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H12Cl2N2O2/c12-9-2-1-8(5-10(9)13)16-4-3-7-6-17-11(14)15-7/h1-2,5,7H,3-4,6H2,(H2,14,15)/t7-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.300	-50.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122318 (US8729113, 30) Show SMILES NC1=N[C@@H](CCC2(CC2)c2ccc(Cl)cc2)CO1 |r,t:1| Show InChI InChI=1S/C14H17ClN2O/c15-11-3-1-10(2-4-11)14(7-8-14)6-5-12-9-18-13(16)17-12/h1-4,12H,5-9H2,(H2,16,17)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.400	-49.9	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122380 (US8729113, 136) Show SMILES NC1=N[C@@H](CCOc2cccc(c2)C(=O)OCc2ccccc2)CO1 |r,t:1| Show InChI InChI=1S/C19H20N2O4/c20-19-21-16(13-25-19)9-10-23-17-8-4-7-15(11-17)18(22)24-12-14-5-2-1-3-6-14/h1-8,11,16H,9-10,12-13H2,(H2,20,21)/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.400	-49.9	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122385 (US8729113, 144) Show SMILES NC1=N[C@@H](CCC2(CC2)c2ccc(Br)cc2)CO1 |r,t:1| Show InChI InChI=1S/C14H17BrN2O/c15-11-3-1-10(2-4-11)14(7-8-14)6-5-12-9-18-13(16)17-12/h1-4,12H,5-9H2,(H2,16,17)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.5	-49.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122296 (US8729113, 3) Show SMILES NC1=N[C@@H](CCOc2ccc(Cl)cc2)CO1 |r,t:1| Show InChI InChI=1S/C11H13ClN2O2/c12-8-1-3-10(4-2-8)15-6-5-9-7-16-11(13)14-9/h1-4,9H,5-7H2,(H2,13,14)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.5	-49.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122319 (US8729113, 31) Show SMILES NC1=N[C@@H](CCC2(CC2)c2ccccc2)CO1 |r,t:1| Show InChI InChI=1S/C14H18N2O/c15-13-16-12(10-17-13)6-7-14(8-9-14)11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H2,15,16)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.5	-49.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122357 (US8729113, 91) Show SMILES NC1=N[C@@H](CCC2(CC2)c2ccc(F)c(Cl)c2)CO1 |r,t:1| Show InChI InChI=1S/C14H16ClFN2O/c15-11-7-9(1-2-12(11)16)14(5-6-14)4-3-10-8-19-13(17)18-10/h1-2,7,10H,3-6,8H2,(H2,17,18)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.600	-48.9	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122320 (US8729113, 32) Show SMILES Cc1cccc(OCC[C@H]2COC(N)=N2)c1 |r,c:13| Show InChI InChI=1S/C12H16N2O2/c1-9-3-2-4-11(7-9)15-6-5-10-8-16-12(13)14-10/h2-4,7,10H,5-6,8H2,1H3,(H2,13,14)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.700	-48.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122373 (US8729113, 122) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Cl)c(Cl)c1 |r,c:8| Show InChI InChI=1S/C13H16Cl2N2O2/c1-2-9(5-8-7-18-13(16)17-8)19-10-3-4-11(14)12(15)6-10/h3-4,6,8-9H,2,5,7H2,1H3,(H2,16,17)/t8-,9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.700	-48.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122386 (US8729113, 150) Show SMILES NC1=N[C@@H](CCSc2ccc(F)cc2)CO1 |r,t:1| Show InChI InChI=1S/C11H13FN2OS/c12-8-1-3-10(4-2-8)16-6-5-9-7-15-11(13)14-9/h1-4,9H,5-7H2,(H2,13,14)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.700	-48.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122377 (US8729113, 130) Show SMILES NC1=N[C@@H](CCOc2cc(F)cc(F)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H12F2N2O2/c12-7-3-8(13)5-10(4-7)16-2-1-9-6-17-11(14)15-9/h3-5,9H,1-2,6H2,(H2,14,15)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.700	-48.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122315 (US8729113, 26) Show SMILES CC(C)(CC[C@H]1COC(N)=N1)c1ccc(Cl)cc1 |r,c:9| Show InChI InChI=1S/C14H19ClN2O/c1-14(2,10-3-5-11(15)6-4-10)8-7-12-9-18-13(16)17-12/h3-6,12H,7-9H2,1-2H3,(H2,16,17)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.700	-48.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122322 (US8729113, 34) Show SMILES NC1=N[C@@H](CCOc2cccc(OCc3ccccc3)c2)CO1 |r,t:1| Show InChI InChI=1S/C18H20N2O3/c19-18-20-15(13-23-18)9-10-21-16-7-4-8-17(11-16)22-12-14-5-2-1-3-6-14/h1-8,11,15H,9-10,12-13H2,(H2,19,20)/t15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.800	-48.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122381 (US8729113, 140) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1cccc(OCc2ccccc2)c1 |r,c:8| Show InChI InChI=1S/C20H24N2O3/c1-2-17(11-16-14-24-20(21)22-16)25-19-10-6-9-18(12-19)23-13-15-7-4-3-5-8-15/h3-10,12,16-17H,2,11,13-14H2,1H3,(H2,21,22)/t16-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.900	-48.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122297 (US8729113, 4) Show SMILES NC1=N[C@@H](CCOc2cccc(c2)C(F)(F)F)CO1 |r,t:1| Show InChI InChI=1S/C12H13F3N2O2/c13-12(14,15)8-2-1-3-10(6-8)18-5-4-9-7-19-11(16)17-9/h1-3,6,9H,4-5,7H2,(H2,16,17)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.900	-48.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122384 (US8729113, 143) Show SMILES NC1=N[C@@H](CCC2(CC2)c2cc(F)cc(Cl)c2)CO1 |r,t:1| Show InChI InChI=1S/C14H16ClFN2O/c15-10-5-9(6-11(16)7-10)14(3-4-14)2-1-12-8-19-13(17)18-12/h5-7,12H,1-4,8H2,(H2,17,18)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.900	-48.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122338 (US8729113, 63) Show SMILES NC1=N[C@@H](CCOc2cccc(c2)C#N)CO1 |r,t:1| Show InChI InChI=1S/C12H13N3O2/c13-7-9-2-1-3-11(6-9)16-5-4-10-8-17-12(14)15-10/h1-3,6,10H,4-5,8H2,(H2,14,15)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1	-47.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122348 (US8729113, 75) Show SMILES C[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Cl)c(Cl)c1 |r,c:7| Show InChI InChI=1S/C12H14Cl2N2O2/c1-7(4-8-6-17-12(15)16-8)18-9-2-3-10(13)11(14)5-9/h2-3,5,7-8H,4,6H2,1H3,(H2,15,16)/t7-,8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1	-47.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122375 (US8729113, 124) Show SMILES CCC(CC[C@H]1COC(N)=N1)c1cc(F)cc(F)c1 |r,c:9| Show InChI InChI=1S/C14H18F2N2O/c1-2-9(3-4-13-8-19-14(17)18-13)10-5-11(15)7-12(16)6-10/h5-7,9,13H,2-4,8H2,1H3,(H2,17,18)/t9?,13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1	-47.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122363 (US8729113, 111) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Br)cc1 |r,c:8| Show InChI InChI=1S/C13H17BrN2O2/c1-2-11(7-10-8-17-13(15)16-10)18-12-5-3-9(14)4-6-12/h3-6,10-11H,2,7-8H2,1H3,(H2,15,16)/t10-,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1	-47.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122359 (US8729113, 107) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Cl)cc1 |r,c:8| Show InChI InChI=1S/C13H17ClN2O2/c1-2-11(7-10-8-17-13(15)16-10)18-12-5-3-9(14)4-6-12/h3-6,10-11H,2,7-8H2,1H3,(H2,15,16)/t10-,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1	-47.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122388 (US8729113, 153) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc2ccccc2c1 |r,c:8| Show InChI InChI=1S/C17H20N2O2/c1-2-15(10-14-11-20-17(18)19-14)21-16-8-7-12-5-3-4-6-13(12)9-16/h3-9,14-15H,2,10-11H2,1H3,(H2,18,19)/t14-,15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.10	-47.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122304 (US8729113, 11) Show SMILES NC1=N[C@@H](CCOc2ccc(F)cc2F)CO1 |r,t:1| Show InChI InChI=1S/C11H12F2N2O2/c12-7-1-2-10(9(13)5-7)16-4-3-8-6-17-11(14)15-8/h1-2,5,8H,3-4,6H2,(H2,14,15)/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.10	-47.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122368 (US8729113, 116) Show SMILES C[C@H](CC[C@H]1COC(N)=N1)c1ccc(F)cc1 |r,c:8| Show InChI InChI=1S/C13H17FN2O/c1-9(10-3-5-11(14)6-4-10)2-7-12-8-17-13(15)16-12/h3-6,9,12H,2,7-8H2,1H3,(H2,15,16)/t9-,12+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.10	-47.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122391 (US8729113, 158) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Cl)cc1Cl |r,c:8| Show InChI InChI=1S/C13H16Cl2N2O2/c1-2-10(6-9-7-18-13(16)17-9)19-12-4-3-8(14)5-11(12)15/h3-5,9-10H,2,6-7H2,1H3,(H2,16,17)/t9-,10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.10	-47.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122341 (US8729113, 68) Show SMILES C[C@@H](C[C@H]1COC(N)=N1)Oc1cccc(Cl)c1 |r,c:7| Show InChI InChI=1S/C12H15ClN2O2/c1-8(5-10-7-16-12(14)15-10)17-11-4-2-3-9(13)6-11/h2-4,6,8,10H,5,7H2,1H3,(H2,14,15)/t8-,10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.20	-47.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122364 (US8729113, 112) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1cccc(Cl)c1 |r,c:8| Show InChI InChI=1S/C13H17ClN2O2/c1-2-11(7-10-8-17-13(15)16-10)18-12-5-3-4-9(14)6-12/h3-6,10-11H,2,7-8H2,1H3,(H2,15,16)/t10-,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.20	-47.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122302 (US8729113, 9) Show SMILES NC1=N[C@@H](CCOc2ccc(F)c(F)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H12F2N2O2/c12-9-2-1-8(5-10(9)13)16-4-3-7-6-17-11(14)15-7/h1-2,5,7H,3-4,6H2,(H2,14,15)/t7-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.20	-47.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122307 (US8729113, 17) Show SMILES CC(CC[C@H]1COC(N)=N1)c1ccc(F)cc1 |r,c:8| Show InChI InChI=1S/C13H17FN2O/c1-9(10-3-5-11(14)6-4-10)2-7-12-8-17-13(15)16-12/h3-6,9,12H,2,7-8H2,1H3,(H2,15,16)/t9?,12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.20	-47.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122317 (US8729113, 28) Show SMILES CCC(CC[C@H]1COC(N)=N1)c1cccc(c1)C(F)(F)F |r,c:9| Show InChI InChI=1S/C15H19F3N2O/c1-2-10(6-7-13-9-21-14(19)20-13)11-4-3-5-12(8-11)15(16,17)18/h3-5,8,10,13H,2,6-7,9H2,1H3,(H2,19,20)/t10?,13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.30	-47.1	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122383 (US8729113, 142) Show SMILES NC1=N[C@@H](CCC2(CC2)c2cc(F)cc(F)c2)CO1 |r,t:1| Show InChI InChI=1S/C14H16F2N2O/c15-10-5-9(6-11(16)7-10)14(3-4-14)2-1-12-8-19-13(17)18-12/h5-7,12H,1-4,8H2,(H2,17,18)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.30	-47.1	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122360 (US8729113, 108) Show SMILES NC1=N[C@@H](CCC2(CC2)c2ccc(F)c(F)c2)CO1 |r,t:1| Show InChI InChI=1S/C14H16F2N2O/c15-11-2-1-9(7-12(11)16)14(5-6-14)4-3-10-8-19-13(17)18-10/h1-2,7,10H,3-6,8H2,(H2,17,18)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.40	-47.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122331 (US8729113, 54) Show SMILES NC1=N[C@@H](CCOc2ccc(Cl)c(F)c2)CO1 |r,t:1| Show InChI InChI=1S/C11H12ClFN2O2/c12-9-2-1-8(5-10(9)13)16-4-3-7-6-17-11(14)15-7/h1-2,5,7H,3-4,6H2,(H2,14,15)/t7-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.40	-47.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122371 (US8729113, 120) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(F)c(Cl)c1 |r,c:8| Show InChI InChI=1S/C13H16ClFN2O2/c1-2-9(5-8-7-18-13(16)17-8)19-10-3-4-12(15)11(14)6-10/h3-4,6,8-9H,2,5,7H2,1H3,(H2,16,17)/t8-,9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.40	-47.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122395 (US8729113, 172) Show SMILES NC1=N[C@@H](CCCCc2ccccc2)CO1 |r,t:1| Show InChI InChI=1S/C13H18N2O/c14-13-15-12(10-16-13)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H2,14,15)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.5	-46.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122361 (US8729113, 109) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccccc1 |r,c:8| Show InChI InChI=1S/C13H18N2O2/c1-2-11(8-10-9-16-13(14)15-10)17-12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3,(H2,14,15)/t10-,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.60	-46.7	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122330 (US8729113, 48) Show SMILES NC1=N[C@@H](CCOc2ccc(cc2)-c2ccc(F)cc2)CO1 |r,t:1| Show InChI InChI=1S/C17H17FN2O2/c18-14-5-1-12(2-6-14)13-3-7-16(8-4-13)21-10-9-15-11-22-17(19)20-15/h1-8,15H,9-11H2,(H2,19,20)/t15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.60	-46.7	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122294 (US8729113, 1) Show SMILES NC1=N[C@@H](CCOc2ccccc2)CO1 |r,t:1| Show InChI InChI=1S/C11H14N2O2/c12-11-13-9(8-15-11)6-7-14-10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H2,12,13)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.70	-46.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122311 (US8729113, 21) Show SMILES CC(C)c1cccc(OCC[C@H]2COC(N)=N2)c1 |r,c:15| Show InChI InChI=1S/C14H20N2O2/c1-10(2)11-4-3-5-13(8-11)17-7-6-12-9-18-14(15)16-12/h3-5,8,10,12H,6-7,9H2,1-2H3,(H2,15,16)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.70	-46.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122316 (US8729113, 27) Show SMILES CCC(CC[C@H]1COC(N)=N1)c1ccc(Cl)cc1 |r,c:9| Show InChI InChI=1S/C14H19ClN2O/c1-2-10(11-3-6-12(15)7-4-11)5-8-13-9-18-14(16)17-13/h3-4,6-7,10,13H,2,5,8-9H2,1H3,(H2,16,17)/t10?,13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.70	-46.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122370 (US8729113, 119) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(F)c(F)c1 |r,c:8| Show InChI InChI=1S/C13H16F2N2O2/c1-2-9(5-8-7-18-13(16)17-8)19-10-3-4-11(14)12(15)6-10/h3-4,6,8-9H,2,5,7H2,1H3,(H2,16,17)/t8-,9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.70	-46.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122321 (US8729113, 33) Show SMILES NC1=N[C@@H](CCOc2cccc(c2)-c2ccccc2)CO1 |r,t:1| Show InChI InChI=1S/C17H18N2O2/c18-17-19-15(12-21-17)9-10-20-16-8-4-7-14(11-16)13-5-2-1-3-6-13/h1-8,11,15H,9-10,12H2,(H2,18,19)/t15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.80	-46.4	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122366 (US8729113, 114) Show SMILES CC[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(F)cc1F |r,c:8| Show InChI InChI=1S/C13H16F2N2O2/c1-2-10(6-9-7-18-13(16)17-9)19-12-4-3-8(14)5-11(12)15/h3-5,9-10H,2,6-7H2,1H3,(H2,16,17)/t9-,10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.90	-46.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122309 (US8729113, 19) Show SMILES NC1=N[C@@H](CCOc2cccc(OC(F)(F)F)c2)CO1 |r,t:1| Show InChI InChI=1S/C12H13F3N2O3/c13-12(14,15)20-10-3-1-2-9(6-10)18-5-4-8-7-19-11(16)17-8/h1-3,6,8H,4-5,7H2,(H2,16,17)/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.10	-46.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122303 (US8729113, 10) Show SMILES NC1=N[C@@H](CCOc2ccc(F)cc2Cl)CO1 |r,t:1| Show InChI InChI=1S/C11H12ClFN2O2/c12-9-5-7(13)1-2-10(9)16-4-3-8-6-17-11(14)15-8/h1-2,5,8H,3-4,6H2,(H2,14,15)/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.10	-46.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122346 (US8729113, 73) Show SMILES C[C@@H](C[C@H]1COC(N)=N1)Oc1ccc(Cl)cc1F |r,c:7| Show InChI InChI=1S/C12H14ClFN2O2/c1-7(4-9-6-17-12(15)16-9)18-11-3-2-8(13)5-10(11)14/h2-3,5,7,9H,4,6H2,1H3,(H2,15,16)/t7-,9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.10	-46.0	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM122393 (US8729113, 162) Show SMILES NC1=N[C@@H](CCC(F)(F)c2ccc(F)cc2)CO1 |r,t:1| Show InChI InChI=1S/C12H13F3N2O/c13-9-3-1-8(2-4-9)12(14,15)6-5-10-7-18-11(16)17-10/h1-4,10H,5-7H2,(H2,16,17)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.20	-45.9	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Binding assay was performed at 4 C. in a final volume of 1 ml, and with an incubation time of 30 min. The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-...				US Patent US8729113 (2014) BindingDB Entry DOI: 10.7270/Q20Z71ZW
					More data for this Ligand-Target Pair

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