Compile Data Set for Download or QSAR

Found 131 hits with Last Name = 'scartoni' and Initial = 'v'   

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
Adenosine receptor A1 (BOVINE)	BDBM50196014 (3-(2-(trifluoromethyl)benzyl)-N-cyclopentyl-5-phen...) Show SMILES FC(F)(F)c1ccccc1Cn1nnc2c(NC3CCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C23H21F3N6/c24-23(25,26)18-13-7-4-10-16(18)14-32-22-19(30-31-32)21(27-17-11-5-6-12-17)28-20(29-22)15-8-2-1-3-9-15/h1-4,7-10,13,17H,5-6,11-12,14H2,(H,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196002 (3-(2-fluorobenzyl)-N-cyclohexyl-5-phenyl-3H-[1,2,3...) Show SMILES Fc1ccccc1Cn1nnc2c(NC3CCCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C23H23FN6/c24-19-14-8-7-11-17(19)15-30-23-20(28-29-30)22(25-18-12-5-2-6-13-18)26-21(27-23)16-9-3-1-4-10-16/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196009 (3-benzyl-N-cyclohexyl-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CCCCC3)cc(nc12)-c1ccccc1 Show InChI InChI=1S/C24H25N5/c1-4-10-18(11-5-1)17-29-24-23(27-28-29)22(25-20-14-8-3-9-15-20)16-21(26-24)19-12-6-2-7-13-19/h1-2,4-7,10-13,16,20H,3,8-9,14-15,17H2,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195990 (3-(2-fluorobenzyl)-5-phenyl-N-propyl-3H-[1,2,3]tri...) Show SMILES CCCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19FN6/c1-2-12-22-19-17-20(24-18(23-19)14-8-4-3-5-9-14)27(26-25-17)13-15-10-6-7-11-16(15)21/h3-11H,2,12-13H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195996 (3-(3-(2-fluorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES OCCCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19FN6O/c21-16-10-5-4-9-15(16)13-27-20-17(25-26-27)19(22-11-6-12-28)23-18(24-20)14-7-2-1-3-8-14/h1-5,7-10,28H,6,11-13H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196018 (3-(2-fluorobenzyl)-N-butyl-5-phenyl-3H-[1,2,3]tria...) Show SMILES CCCCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C21H21FN6/c1-2-3-13-23-20-18-21(25-19(24-20)15-9-5-4-6-10-15)28(27-26-18)14-16-11-7-8-12-17(16)22/h4-12H,2-3,13-14H2,1H3,(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195995 (1-(3-(2-fluorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES CC(O)CNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19FN6O/c1-13(28)11-22-19-17-20(24-18(23-19)14-7-3-2-4-8-14)27(26-25-17)12-15-9-5-6-10-16(15)21/h2-10,13,28H,11-12H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195992 (3-benzyl-N-cyclobutyl-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C21H20N6/c1-3-8-15(9-4-1)14-27-21-18(25-26-27)20(22-17-12-7-13-17)23-19(24-21)16-10-5-2-6-11-16/h1-6,8-11,17H,7,12-14H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196015 (3-(2-(trifluoromethyl)benzyl)-N-butyl-5-phenyl-3H-...) Show SMILES CCCCNc1nc(nc2n(Cc3ccccc3C(F)(F)F)nnc12)-c1ccccc1 Show InChI InChI=1S/C22H21F3N6/c1-2-3-13-26-20-18-21(28-19(27-20)15-9-5-4-6-10-15)31(30-29-18)14-16-11-7-8-12-17(16)22(23,24)25/h4-12H,2-3,13-14H2,1H3,(H,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196003 (3-(2-fluorobenzyl)-N-cyclopentyl-5-phenyl-3H-[1,2,...) Show SMILES Fc1ccccc1Cn1nnc2c(NC3CCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C22H21FN6/c23-18-13-7-4-10-16(18)14-29-22-19(27-28-29)21(24-17-11-5-6-12-17)25-20(26-22)15-8-2-1-3-9-15/h1-4,7-10,13,17H,5-6,11-12,14H2,(H,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196030 (3-(2-(trifluoromethyl)benzyl)-N-cyclohexyl-5-pheny...) Show SMILES FC(F)(F)c1ccccc1Cn1nnc2c(NC3CCCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C24H23F3N6/c25-24(26,27)19-14-8-7-11-17(19)15-33-23-20(31-32-33)22(28-18-12-5-2-6-13-18)29-21(30-23)16-9-3-1-4-10-16/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195999 (1-(3-benzyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d]pyri...) Show SMILES CC(O)CNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H20N6O/c1-14(27)12-21-19-17-20(23-18(22-19)16-10-6-3-7-11-16)26(25-24-17)13-15-8-4-2-5-9-15/h2-11,14,27H,12-13H2,1H3,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196020 (3-(2-(trifluoromethyl)benzyl)-N-cyclopropyl-5-phen...) Show SMILES FC(F)(F)c1ccccc1Cn1nnc2c(NC3CC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C21H17F3N6/c22-21(23,24)16-9-5-4-8-14(16)12-30-20-17(28-29-30)19(25-15-10-11-15)26-18(27-20)13-6-2-1-3-7-13/h1-9,15H,10-12H2,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196011 (3-(2-chlorobenzyl)-N-cyclopentyl-5-phenyl-3H-[1,2,...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C22H21ClN6/c23-18-13-7-4-10-16(18)14-29-22-19(27-28-29)21(24-17-11-5-6-12-17)25-20(26-22)15-8-2-1-3-9-15/h1-4,7-10,13,17H,5-6,11-12,14H2,(H,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Homo sapiens (Human))	BDBM50051737 (2-Hexylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL86...) Show SMILES CCCCCCSc1nc2nc[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C11H16N4OS/c1-2-3-4-5-6-17-11-14-9-8(10(16)15-11)12-7-13-9/h7H,2-6H2,1H3,(H2,12,13,14,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Modena Curated by ChEMBL					Assay Description Inhibitory activity against Xanthine Oxidase				J Med Chem 39: 2529-35 (1996) Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195997 (3-(2-chlorobenzyl)-N-cyclopropyl-5-phenyl-3H-[1,2,...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C20H17ClN6/c21-16-9-5-4-8-14(16)12-27-20-17(25-26-27)19(22-15-10-11-15)23-18(24-20)13-6-2-1-3-7-13/h1-9,15H,10-12H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196022 (3-benzyl-N-cyclopentyl-5-phenyl-3H-[1,2,3]triazolo...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C22H22N6/c1-3-9-16(10-4-1)15-28-22-19(26-27-28)21(23-18-13-7-8-14-18)24-20(25-22)17-11-5-2-6-12-17/h1-6,9-12,18H,7-8,13-15H2,(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196012 (3-benzyl-N-butyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d...) Show SMILES CCCCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C21H22N6/c1-2-3-14-22-20-18-21(24-19(23-20)17-12-8-5-9-13-17)27(26-25-18)15-16-10-6-4-7-11-16/h4-13H,2-3,14-15H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196010 (3-(2-fluorobenzyl)-N-ethyl-5-phenyl-3H-[1,2,3]tria...) Show SMILES CCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H17FN6/c1-2-21-18-16-19(23-17(22-18)13-8-4-3-5-9-13)26(25-24-16)12-14-10-6-7-11-15(14)20/h3-11H,2,12H2,1H3,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195994 (3-benzyl-N-cyclopropyl-5-phenyl-3H-[1,2,3]triazolo...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C20H18N6/c1-3-7-14(8-4-1)13-26-20-17(24-25-26)19(21-16-11-12-16)22-18(23-20)15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196023 (3-benzyl-N-hexyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d...) Show SMILES CCCCCCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C23H26N6/c1-2-3-4-11-16-24-22-20-23(26-21(25-22)19-14-9-6-10-15-19)29(28-27-20)17-18-12-7-5-8-13-18/h5-10,12-15H,2-4,11,16-17H2,1H3,(H,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196026 (3-(2-(trifluoromethyl)benzyl)-N-methyl-5-phenyl-3H...) Show SMILES CNc1nc(nc2n(Cc3ccccc3C(F)(F)F)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H15F3N6/c1-23-17-15-18(25-16(24-17)12-7-3-2-4-8-12)28(27-26-15)11-13-9-5-6-10-14(13)19(20,21)22/h2-10H,11H2,1H3,(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195998 (3-(2-fluorobenzyl)-N-cyclopropyl-5-phenyl-3H-[1,2,...) Show SMILES Fc1ccccc1Cn1nnc2c(NC3CC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C20H17FN6/c21-16-9-5-4-8-14(16)12-27-20-17(25-26-27)19(22-15-10-11-15)23-18(24-20)13-6-2-1-3-7-13/h1-9,15H,10-12H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063215 (CHEMBL158859 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CCCC3)ncnc12 Show InChI InChI=1S/C16H17ClN6/c17-13-8-4-1-5-11(13)9-23-16-14(21-22-23)15(18-10-19-16)20-12-6-2-3-7-12/h1,4-5,8,10,12H,2-3,6-7,9H2,(H,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196007 (3-(3-benzyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d]pyri...) Show SMILES OCCCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H20N6O/c27-13-7-12-21-19-17-20(23-18(22-19)16-10-5-2-6-11-16)26(25-24-17)14-15-8-3-1-4-9-15/h1-6,8-11,27H,7,12-14H2,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195993 (3-(2-chlorobenzyl)-N-cyclobutyl-5-phenyl-3H-[1,2,3...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C21H19ClN6/c22-17-12-5-4-9-15(17)13-28-21-18(26-27-28)20(23-16-10-6-11-16)24-19(25-21)14-7-2-1-3-8-14/h1-5,7-9,12,16H,6,10-11,13H2,(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196019 (3-(2-fluorobenzyl)-N-methyl-5-phenyl-3H-[1,2,3]tri...) Show SMILES CNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C18H15FN6/c1-20-17-15-18(22-16(21-17)12-7-3-2-4-8-12)25(24-23-15)11-13-9-5-6-10-14(13)19/h2-10H,11H2,1H3,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196024 (3-(2-fluorobenzyl)-N-hexyl-5-phenyl-3H-[1,2,3]tria...) Show SMILES CCCCCCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C23H25FN6/c1-2-3-4-10-15-25-22-20-23(27-21(26-22)17-11-6-5-7-12-17)30(29-28-20)16-18-13-8-9-14-19(18)24/h5-9,11-14H,2-4,10,15-16H2,1H3,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196016 (3-(2-chlorobenzyl)-N-hexyl-5-phenyl-3H-[1,2,3]tria...) Show SMILES CCCCCCNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C23H25ClN6/c1-2-3-4-10-15-25-22-20-23(27-21(26-22)17-11-6-5-7-12-17)30(29-28-20)16-18-13-8-9-14-19(18)24/h5-9,11-14H,2-4,10,15-16H2,1H3,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196013 (1-(3-(2-chlorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES CC(O)CNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19ClN6O/c1-13(28)11-22-19-17-20(24-18(23-19)14-7-3-2-4-8-14)27(26-25-17)12-15-9-5-6-10-16(15)21/h2-10,13,28H,11-12H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196029 (3-(3-(2-chlorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES OCCCNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19ClN6O/c21-16-10-5-4-9-15(16)13-27-20-17(25-26-27)19(22-11-6-12-28)23-18(24-20)14-7-2-1-3-8-14/h1-5,7-10,28H,6,11-13H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196006 (3-(2-chlorobenzyl)-N-cyclohexyl-5-phenyl-3H-[1,2,3...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CCCCC3)nc(nc12)-c1ccccc1 Show InChI InChI=1S/C23H23ClN6/c24-19-14-8-7-11-17(19)15-30-23-20(28-29-30)22(25-18-12-5-2-6-13-18)26-21(27-23)16-9-3-1-4-10-16/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196025 (3-benzyl-5-phenyl-N-propyl-3H-[1,2,3]triazolo[4,5-...) Show SMILES CCCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H20N6/c1-2-13-21-19-17-20(23-18(22-19)16-11-7-4-8-12-16)26(25-24-17)14-15-9-5-3-6-10-15/h3-12H,2,13-14H2,1H3,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196000 (2-(3-benzyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d]pyri...) Show SMILES OCCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H18N6O/c26-12-11-20-18-16-19(22-17(21-18)15-9-5-2-6-10-15)25(24-23-16)13-14-7-3-1-4-8-14/h1-10,26H,11-13H2,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	38	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50408698 (CHEMBL2112325) Show SMILES C[C@H](Cc1ccccc1)Nc1ncnc2n(Cc3ccccc3Cl)nnc12 |r| Show InChI InChI=1S/C20H19ClN6/c1-14(11-15-7-3-2-4-8-15)24-19-18-20(23-13-22-19)27(26-25-18)12-16-9-5-6-10-17(16)21/h2-10,13-14H,11-12H2,1H3,(H,22,23,24)/t14-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063204 (CHEMBL161711 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES Clc1ccccc1Cn1nnc2c(NC3CCCCC3)ncnc12 Show InChI InChI=1S/C17H19ClN6/c18-14-9-5-4-6-12(14)10-24-17-15(22-23-24)16(19-11-20-17)21-13-7-2-1-3-8-13/h4-6,9,11,13H,1-3,7-8,10H2,(H,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196005 (2-(3-(2-fluorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES OCCNc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H17FN6O/c20-15-9-5-4-8-14(15)12-26-19-16(24-25-26)18(21-10-11-27)22-17(23-19)13-6-2-1-3-7-13/h1-9,27H,10-12H2,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063190 (CHEMBL159178 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES CC(Cc1ccccc1)Nc1ncnc2n(Cc3ccccc3Cl)nnc12 Show InChI InChI=1S/C20H19ClN6/c1-14(11-15-7-3-2-4-8-15)24-19-18-20(23-13-22-19)27(26-25-18)12-16-9-5-6-10-17(16)21/h2-10,13-14H,11-12H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	73	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196008 (3-(2-chlorobenzyl)-N-butyl-5-phenyl-3H-[1,2,3]tria...) Show SMILES CCCCNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C21H21ClN6/c1-2-3-13-23-20-18-21(25-19(24-20)15-9-5-4-6-10-15)28(27-26-18)14-16-11-7-8-12-17(16)22/h4-12H,2-3,13-14H2,1H3,(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	79	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196004 (3-benzyl-N-ethyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d...) Show SMILES CCNc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H18N6/c1-2-20-18-16-19(22-17(21-18)15-11-7-4-8-12-15)25(24-23-16)13-14-9-5-3-6-10-14/h3-12H,2,13H2,1H3,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196027 (3-(2-chlorobenzyl)-5-phenyl-N-propyl-3H-[1,2,3]tri...) Show SMILES CCCNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C20H19ClN6/c1-2-12-22-19-17-20(24-18(23-19)14-8-4-3-5-9-14)27(26-25-17)13-15-10-6-7-11-16(15)21/h3-11H,2,12-13H2,1H3,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	101	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063184 (CHEMBL161051 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES CC1CCCC(C1)Nc1ncnc2n(Cc3ccccc3Cl)nnc12 Show InChI InChI=1S/C18H21ClN6/c1-12-5-4-7-14(9-12)22-17-16-18(21-11-20-17)25(24-23-16)10-13-6-2-3-8-15(13)19/h2-3,6,8,11-12,14H,4-5,7,9-10H2,1H3,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	102	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50196028 (2-(3-(2-chlorobenzyl)-5-phenyl-3H-[1,2,3]triazolo[...) Show SMILES OCCNc1nc(nc2n(Cc3ccccc3Cl)nnc12)-c1ccccc1 Show InChI InChI=1S/C19H17ClN6O/c20-15-9-5-4-8-14(15)12-26-19-16(24-25-26)18(21-10-11-27)22-17(23-19)13-6-2-1-3-7-13/h1-9,27H,10-12H2,(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063189 (CHEMBL158598 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES Cc1ccc(Nc2ncnc3n(Cc4ccccc4Cl)nnc23)cc1 Show InChI InChI=1S/C18H15ClN6/c1-12-6-8-14(9-7-12)22-17-16-18(21-11-20-17)25(24-23-16)10-13-4-2-3-5-15(13)19/h2-9,11H,10H2,1H3,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	119	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063198 ((3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CCCCC3)ncnc12 Show InChI InChI=1S/C17H20N6/c1-3-7-13(8-4-1)11-23-17-15(21-22-23)16(18-12-19-17)20-14-9-5-2-6-10-14/h1,3-4,7-8,12,14H,2,5-6,9-11H2,(H,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50063185 ((3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)...) Show SMILES C(c1ccccc1)n1nnc2c(NC3CCCC3)ncnc12 Show InChI InChI=1S/C16H18N6/c1-2-6-12(7-3-1)10-22-16-14(20-21-22)15(17-11-18-16)19-13-8-4-5-9-13/h1-3,6-7,11,13H,4-5,8-10H2,(H,17,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	127	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50195991 (3-(3-(2-(trifluoromethyl)benzyl)-5-phenyl-3H-[1,2,...) Show SMILES OCCCNc1nc(nc2n(Cc3ccccc3C(F)(F)F)nnc12)-c1ccccc1 Show InChI InChI=1S/C21H19F3N6O/c22-21(23,24)16-10-5-4-9-15(16)13-30-20-17(28-29-30)19(25-11-6-12-31)26-18(27-20)14-7-2-1-3-8-14/h1-5,7-10,31H,6,11-13H2,(H,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	147	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from bovine cerbral cortex adenosine A1 receptor				Eur J Med Chem 42: 1-9 (2007) Article DOI: 10.1016/j.ejmech.2006.08.014 BindingDB Entry DOI: 10.7270/Q28C9VW9
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Homo sapiens (Human))	BDBM50051727 (2-Pentylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL8...) Show SMILES CCCCCSc1nc2nc[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C10H14N4OS/c1-2-3-4-5-16-10-13-8-7(9(15)14-10)11-6-12-8/h6H,2-5H2,1H3,(H2,11,12,13,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	155	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Modena Curated by ChEMBL					Assay Description Inhibitory activity against Xanthine Oxidase				J Med Chem 39: 2529-35 (1996) Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Homo sapiens (Human))	BDBM50051734 (2-Hexylsulfanyl-8-hydroxy-1,9-dihydro-purin-6-one ...) Show SMILES CCCCCCSc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C11H16N4O2S/c1-2-3-4-5-6-18-11-14-8-7(9(16)15-11)12-10(17)13-8/h2-6H2,1H3,(H3,12,13,14,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Modena Curated by ChEMBL					Assay Description Inhibitory activity against Xanthine Oxidase				J Med Chem 39: 2529-35 (1996) Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Homo sapiens (Human))	BDBM50051711 (2-Butylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL84...) Show SMILES CCCCSc1nc2nc[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C9H12N4OS/c1-2-3-4-15-9-12-7-6(8(14)13-9)10-5-11-7/h5H,2-4H2,1H3,(H2,10,11,12,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	176	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Modena Curated by ChEMBL					Assay Description Inhibitory activity against Xanthine Oxidase				J Med Chem 39: 2529-35 (1996) Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS
					More data for this Ligand-Target Pair

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