Compile Data Set for Download or QSAR

Found 581 hits with Last Name = 'zbinden' and Initial = 'kg'   

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))	BDBM106590 (US8586617, 51) Show SMILES Clc1cccc(c1)N(CC1CC1)Cc1cnc[nH]1 Show InChI InChI=1S/C14H16ClN3/c15-12-2-1-3-14(6-12)18(8-11-4-5-11)9-13-7-16-10-17-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,16,17)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106631 (US8586617, 192) Show SMILES CCN(Cc1cnc[nH]1)c1cccc(OCc2ccccc2)c1 Show InChI InChI=1S/C19H21N3O/c1-2-22(13-17-12-20-15-21-17)18-9-6-10-19(11-18)23-14-16-7-4-3-5-8-16/h3-12,15H,2,13-14H2,1H3,(H,20,21)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM47082 (CHEMBL2206377 | US8586617, 24) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C13H15Cl2N3/c1-9(2)18(7-12-6-16-8-17-12)13-4-10(14)3-11(15)5-13/h3-6,8-9H,7H2,1-2H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106672 (US8586617, 333) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(OC(F)(F)F)c(Cl)c1 Show InChI InChI=1S/C13H13ClF3N3O/c1-2-20(7-9-6-18-8-19-9)10-3-4-12(11(14)5-10)21-13(15,16)17/h3-6,8H,2,7H2,1H3,(H,18,19)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106671 (US8586617, 331) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(Br)c(Cl)c1 Show InChI InChI=1S/C13H15BrClN3/c1-9(2)18(7-10-6-16-8-17-10)11-3-4-12(14)13(15)5-11/h3-6,8-9H,7H2,1-2H3,(H,16,17)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106667 (US8586617, 312) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(F)c(Cl)c1 Show InChI InChI=1S/C12H13ClFN3/c1-2-17(7-9-6-15-8-16-9)10-3-4-12(14)11(13)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106665 (US8586617, 308) Show SMILES CCN(Cc1cnc[nH]1)c1cc(F)cc(Cl)c1 Show InChI InChI=1S/C12H13ClFN3/c1-2-17(7-11-6-15-8-16-11)12-4-9(13)3-10(14)5-12/h3-6,8H,2,7H2,1H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106661 (CHEMBL2206385 | US8586617, 304) Show SMILES CCN(Cc1cnc[nH]1)c1cccc(Cl)c1 Show InChI InChI=1S/C12H14ClN3/c1-2-16(8-11-7-14-9-15-11)12-5-3-4-10(13)6-12/h3-7,9H,2,8H2,1H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106660 (US8586617, 303) Show SMILES CCN(Cc1cnc[nH]1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C12H13Cl2N3/c1-2-17(7-11-6-15-8-16-11)12-4-9(13)3-10(14)5-12/h3-6,8H,2,7H2,1H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106658 (US8586617, 297) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(Br)c(Br)c1 Show InChI InChI=1S/C13H15Br2N3/c1-9(2)18(7-10-6-16-8-17-10)11-3-4-12(14)13(15)5-11/h3-6,8-9H,7H2,1-2H3,(H,16,17)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106655 (US8586617, 291) Show SMILES CN(Cc1cnc[nH]1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C11H11Cl2N3/c1-16(6-10-5-14-7-15-10)11-3-8(12)2-9(13)4-11/h2-5,7H,6H2,1H3,(H,14,15)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106648 (US8586617, 275) Show SMILES CCN(Cc1cnc[nH]1)c1cccc(Br)c1 Show InChI InChI=1S/C12H14BrN3/c1-2-16(8-11-7-14-9-15-11)12-5-3-4-10(13)6-12/h3-7,9H,2,8H2,1H3,(H,14,15)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106641 (US8586617, 225) Show SMILES Brc1cccc(NCc2cnc[nH]2)c1 Show InChI InChI=1S/C10H10BrN3/c11-8-2-1-3-9(4-8)13-6-10-5-12-7-14-10/h1-5,7,13H,6H2,(H,12,14)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase 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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106642 (US8586617, 226) Show SMILES FC(F)(F)c1cc(Br)cc(NCc2cnc[nH]2)c1 Show InChI InChI=1S/C11H9BrF3N3/c12-8-1-7(11(13,14)15)2-9(3-8)17-5-10-4-16-6-18-10/h1-4,6,17H,5H2,(H,16,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106645 (US8586617, 242) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(Br)c1 Show InChI InChI=1S/C13H16BrN3/c1-10(2)17(8-12-7-15-9-16-12)13-5-3-4-11(14)6-13/h3-7,9-10H,8H2,1-2H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106647 (US8586617, 247) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C12H13Cl2N3/c1-2-17(7-9-6-15-8-16-9)10-3-4-11(13)12(14)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106599 (US8586617, 76) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cc(F)cc(Cl)c1 Show InChI InChI=1S/C13H15ClFN3/c1-9(2)18(7-12-6-16-8-17-12)13-4-10(14)3-11(15)5-13/h3-6,8-9H,7H2,1-2H3,(H,16,17)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106582 (CHEMBL2206890 | US8586617, 23) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(Cl)c1 Show InChI InChI=1S/C13H16ClN3/c1-10(2)17(8-12-7-15-9-16-12)13-5-3-4-11(14)6-13/h3-7,9-10H,8H2,1-2H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106588 (CHEMBL2206376 | US8586617, 32) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C13H15Cl2N3/c1-9(2)18(7-10-6-16-8-17-10)11-3-4-12(14)13(15)5-11/h3-6,8-9H,7H2,1-2H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106603 (US8586617, 82) Show SMILES CCN(Cc1cnc[nH]1)c1ccc2ccccc2c1 Show InChI InChI=1S/C16H17N3/c1-2-19(11-15-10-17-12-18-15)16-8-7-13-5-3-4-6-14(13)9-16/h3-10,12H,2,11H2,1H3,(H,17,18)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106575 (CHEMBL2206384 | US8586617, 9) Show SMILES CN(Cc1cnc[nH]1)c1cccc(Cl)c1 Show InChI InChI=1S/C11H12ClN3/c1-15(7-10-6-13-8-14-10)11-4-2-3-9(12)5-11/h2-6,8H,7H2,1H3,(H,13,14)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106629 (US8586617, 190) Show SMILES CN(Cc1cnc[nH]1)c1cccc(OCc2ccccc2)c1 Show InChI InChI=1S/C18H19N3O/c1-21(12-16-11-19-14-20-16)17-8-5-9-18(10-17)22-13-15-6-3-2-4-7-15/h2-11,14H,12-13H2,1H3,(H,19,20)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106593 (US8586617, 57) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Cl)cc1 Show InChI InChI=1S/C12H14ClN3/c1-2-16(8-11-7-14-9-15-11)12-5-3-10(13)4-6-12/h3-7,9H,2,8H2,1H3,(H,14,15)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106594 (US8586617, 58) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(F)c(F)c1 Show InChI InChI=1S/C12H13F2N3/c1-2-17(7-9-6-15-8-16-9)10-3-4-11(13)12(14)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106617 (US8586617, 141) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(Cc2ccccc2)c1 Show InChI InChI=1S/C20H23N3/c1-16(2)23(14-19-13-21-15-22-19)20-10-6-9-18(12-20)11-17-7-4-3-5-8-17/h3-10,12-13,15-16H,11,14H2,1-2H3,(H,21,22)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106592 (US8586617, 53) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(F)c(Cl)c1 Show InChI InChI=1S/C13H15ClFN3/c1-9(2)18(7-10-6-16-8-17-10)11-3-4-13(15)12(14)5-11/h3-6,8-9H,7H2,1-2H3,(H,16,17)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106573 (US8586617, 6) Show SMILES CCN(Cc1cnc[nH]1)c1cccc(C)c1 Show InChI InChI=1S/C13H17N3/c1-3-16(9-12-8-14-10-15-12)13-6-4-5-11(2)7-13/h4-8,10H,3,9H2,1-2H3,(H,14,15)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM13554 ((2S)-2-{2-[2-(benzenesulfonyl)-4-(benzyloxy)-5-met...) Show SMILES COc1cc(C(Nc2ccc(cc2)C(N)=N)C(=O)N[C@H](C(O)=O)c2ccccc2)c(cc1OCc1ccccc1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C37H34N4O7S/c1-47-30-21-29(32(49(45,46)28-15-9-4-10-16-28)22-31(30)48-23-24-11-5-2-6-12-24)34(40-27-19-17-26(18-20-27)35(38)39)36(42)41-33(37(43)44)25-13-7-3-8-14-25/h2-22,33-34,40H,23H2,1H3,(H3,38,39)(H,41,42)(H,43,44)/t33-,34?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2	-49.2	n/a	n/a	n/a	n/a	n/a	7.8	22
F. Hoffmann-La Roche Ltd.					Assay Description The enzyme reactions were initiated by the addition of substrate, and the color developed from the release of p-nitroanilide from each chromogenic su...				Bioorg Med Chem Lett 15: 5344-52 (2005) Article DOI: 10.1016/j.bmcl.2005.04.079 BindingDB Entry DOI: 10.7270/Q2X63K6X
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106670 (US8586617, 327) Show SMILES FC(F)(F)Oc1ccc(NCc2cnc[nH]2)cc1Cl Show InChI InChI=1S/C11H9ClF3N3O/c12-9-3-7(17-5-8-4-16-6-18-8)1-2-10(9)19-11(13,14)15/h1-4,6,17H,5H2,(H,16,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106669 (US8586617, 325) Show SMILES Clc1cc(NCc2cnc[nH]2)ccc1Br Show InChI InChI=1S/C10H9BrClN3/c11-9-2-1-7(3-10(9)12)14-5-8-4-13-6-15-8/h1-4,6,14H,5H2,(H,13,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106668 (US8586617, 324) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Cl)c(OC)c1 Show InChI InChI=1S/C13H16ClN3O/c1-3-17(8-10-7-15-9-16-10)11-4-5-12(14)13(6-11)18-2/h4-7,9H,3,8H2,1-2H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106639 (US8586617, 207) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(COc2ccccc2)c1 Show InChI InChI=1S/C20H23N3O/c1-16(2)23(13-18-12-21-15-22-18)19-8-6-7-17(11-19)14-24-20-9-4-3-5-10-20/h3-12,15-16H,13-14H2,1-2H3,(H,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106664 (US8586617, 307) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Cl)c(F)c1 Show InChI InChI=1S/C12H13ClFN3/c1-2-17(7-9-6-15-8-16-9)10-3-4-11(13)12(14)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106652 (US8586617, 284) Show SMILES CN(Cc1cnc[nH]1)c1cccc(Br)c1 Show InChI InChI=1S/C11H12BrN3/c1-15(7-10-6-13-8-14-10)11-4-2-3-9(12)5-11/h2-6,8H,7H2,1H3,(H,13,14)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106654 (US8586617, 288) Show SMILES CN(Cc1cnc[nH]1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C11H11Cl2N3/c1-16(6-8-5-14-7-15-8)9-2-3-10(12)11(13)4-9/h2-5,7H,6H2,1H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106662 (US8586617, 305) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Br)c(F)c1 Show InChI InChI=1S/C12H13BrFN3/c1-2-17(7-9-6-15-8-16-9)10-3-4-11(13)12(14)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106663 (US8586617, 306) Show SMILES CCN(Cc1cnc[nH]1)c1cc(F)cc(F)c1 Show InChI InChI=1S/C12H13F2N3/c1-2-17(7-11-6-15-8-16-11)12-4-9(13)3-10(14)5-12/h3-6,8H,2,7H2,1H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106643 (US8586617, 228) Show SMILES CC(C)c1cccc(NCc2cnc[nH]2)c1 Show InChI InChI=1S/C13H17N3/c1-10(2)11-4-3-5-12(6-11)15-8-13-7-14-9-16-13/h3-7,9-10,15H,8H2,1-2H3,(H,14,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2	-46.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106611 (US8586617, 123) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C19H21N3O/c1-15(2)22(13-16-12-20-14-21-16)17-7-6-10-19(11-17)23-18-8-4-3-5-9-18/h3-12,14-15H,13H2,1-2H3,(H,20,21)	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 Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106585 (US8586617, 27) Show SMILES CC(C)N(Cc1cnc[nH]1)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C14H16F3N3/c1-10(2)20(8-12-7-18-9-19-12)13-5-3-4-11(6-13)14(15,16)17/h3-7,9-10H,8H2,1-2H3,(H,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.30	-45.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106613 (US8586617, 128) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(C)c(Cl)c1 Show InChI InChI=1S/C14H18ClN3/c1-10(2)18(8-12-7-16-9-17-12)13-5-4-11(3)14(15)6-13/h4-7,9-10H,8H2,1-3H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.30	-45.8	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106608 (CHEMBL2206388 | US8586617, 113) Show SMILES COc1cccc(n1)N(Cc1cnc[nH]1)C(C)C Show InChI InChI=1S/C13H18N4O/c1-10(2)17(8-11-7-14-9-15-11)12-5-4-6-13(16-12)18-3/h4-7,9-10H,8H2,1-3H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	2.40	-45.7	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106628 (US8586617, 188) Show SMILES CCN(Cc1cnc[nH]1)c1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C18H19N3O/c1-2-21(13-15-12-19-14-20-15)16-7-6-10-18(11-16)22-17-8-4-3-5-9-17/h3-12,14H,2,13H2,1H3,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.40	-45.7	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106622 (US8586617, 170) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(F)c(Br)c1 Show InChI InChI=1S/C13H15BrFN3/c1-9(2)18(7-10-6-16-8-17-10)11-3-4-13(15)12(14)5-11/h3-6,8-9H,7H2,1-2H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.5	-45.6	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106624 (US8586617, 179) Show SMILES Fc1cc(Cl)cc(NCc2cnc[nH]2)c1 Show InChI InChI=1S/C10H9ClFN3/c11-7-1-8(12)3-9(2-7)14-5-10-4-13-6-15-10/h1-4,6,14H,5H2,(H,13,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.60	-45.5	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106635 (US8586617, 200) Show SMILES Clc1cccc(Oc2cccc(NCc3cnc[nH]3)c2)c1 Show InChI InChI=1S/C16H14ClN3O/c17-12-3-1-5-15(7-12)21-16-6-2-4-13(8-16)19-10-14-9-18-11-20-14/h1-9,11,19H,10H2,(H,18,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.80	-45.4	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106589 (US8586617, 33) Show SMILES CC(C)N(Cc1cnc[nH]1)c1ccc(OC(F)(F)F)c(Cl)c1 Show InChI InChI=1S/C14H15ClF3N3O/c1-9(2)21(7-10-6-19-8-20-10)11-3-4-13(12(15)5-11)22-14(16,17)18/h3-6,8-9H,7H2,1-2H3,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.80	-45.4	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106572 (US8586617, 4) Show SMILES CN(Cc1cnc[nH]1)c1cccc(F)c1 Show InChI InChI=1S/C11H12FN3/c1-15(7-10-6-13-8-14-10)11-4-2-3-9(12)5-11/h2-6,8H,7H2,1H3,(H,13,14)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.90	-45.3	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Mus musculus (Mouse))	BDBM106659 (US8586617, 302) Show SMILES CCN(Cc1cnc[nH]1)c1ccc(Br)cc1 Show InChI InChI=1S/C12H14BrN3/c1-2-16(8-11-7-14-9-15-11)12-5-3-10(13)4-6-12/h3-7,9H,2,8H2,1H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	3	-45.2	n/a	n/a	n/a	n/a	n/a	n/a	4
Hoffmann-La Roche Inc. US Patent					Assay Description Radioligand binding assay: The radioligand [3H]-rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline was used at a concentration equal to the calcula...				US Patent US8586617 (2013) BindingDB Entry DOI: 10.7270/Q2GF0S56
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50295588 (5-chloro-N-((3S,4S)-1-(2-(2-fluoro-4-(2-oxopyridin...) Show SMILES CO[C@H]1CN(CC(=O)Nc2ccc(cc2F)-n2ccccc2=O)C[C@@H]1NC(=O)c1ccc(Cl)s1 |r| Show InChI InChI=1S/C23H22ClFN4O4S/c1-33-18-12-28(11-17(18)27-23(32)19-7-8-20(24)34-19)13-21(30)26-16-6-5-14(10-15(16)25)29-9-3-2-4-22(29)31/h2-10,17-18H,11-13H2,1H3,(H,26,30)(H,27,32)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F Hoffmann - La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Eur J Med Chem 44: 2787-95 (2009) Article DOI: 10.1016/j.ejmech.2008.12.025 BindingDB Entry DOI: 10.7270/Q2CV4HSP
					More data for this Ligand-Target Pair				3D Structure (crystal)

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