Compile Data Set for Download or QSAR

Found 135 hits with Last Name = 'rimoli' and Initial = 'mg'   

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 (Homo sapiens (Human))	BDBM21216 (2-[4-(ethylsulfanyl)-1H-1,3-benzodiazol-2-yl]quino...) Show SMILES CCSc1cccc2nc([nH]c12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C17H14N4S/c1-2-22-15-9-5-8-13-16(15)21-17(20-13)14-10-18-11-6-3-4-7-12(11)19-14/h3-10H,2H2,1H3,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM21173 (1,3-dipropyl-8-cyclopentylxanthine | 8-cyclopentyl...) Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1 Show InChI InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179306 (2-(4-(methylthio)-1H-benzo[d]imidazol-2-yl)quinoxa...) Show SMILES CSc1cccc2nc([nH]c12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C16H12N4S/c1-21-14-8-4-7-12-15(14)20-16(19-12)13-9-17-10-5-2-3-6-11(10)18-13/h2-9H,1H3,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120763 (CHEMBL358076 | Cyclopentanecarboxylic acid (7-ethy...) Show SMILES CCc1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-2-15-12-24-18(20-15)21-16(13-8-4-3-5-9-13)22-19(24)23-17(25)14-10-6-7-11-14/h3-5,8-9,12,14H,2,6-7,10-11H2,1H3,(H,20,21,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.30	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179304 (2-(6-chloro-4-methyl-1H-benzo[d]imidazol-2-yl)quin...) Show SMILES Cc1cc(Cl)cc2[nH]c(nc12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C16H11ClN4/c1-9-6-10(17)7-13-15(9)21-16(20-13)14-8-18-11-4-2-3-5-12(11)19-14/h2-8H,1H3,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120761 (CHEMBL355898 | Cyclopentanecarboxylic acid (7-meth...) Show SMILES Cc1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C18H19N5O/c1-12-11-23-17(19-12)20-15(13-7-3-2-4-8-13)21-18(23)22-16(24)14-9-5-6-10-14/h2-4,7-8,11,14H,5-6,9-10H2,1H3,(H,19,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.40	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120767 (CHEMBL148464 | Cyclopentanecarboxylic acid (7-isop...) Show SMILES CC(C)c1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C20H23N5O/c1-13(2)16-12-25-19(21-16)22-17(14-8-4-3-5-9-14)23-20(25)24-18(26)15-10-6-7-11-15/h3-5,8-9,12-13,15H,6-7,10-11H2,1-2H3,(H,21,22,23,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.80	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179293 (2-(4,6-dichloro-1H-benzo[d]imidazol-2-yl)quinoxali...) Show SMILES Clc1cc(Cl)c2[nH]c(nc2c1)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H8Cl2N4/c16-8-5-9(17)14-12(6-8)20-15(21-14)13-7-18-10-3-1-2-4-11(10)19-13/h1-7H,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120759 (CHEMBL146479 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...) Show SMILES Cc1cn2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H15N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2-12H,1H3,(H,20,21,22,23,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11.8	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120765 (1-(7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-...) Show SMILES CC(=O)CNc1nc(nc2nc(C)cn12)-c1ccccc1 Show InChI InChI=1S/C15H15N5O/c1-10-9-20-14(16-8-11(2)21)18-13(19-15(20)17-10)12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3,(H,16,17,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	12	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Adenosine receptor A1 (BOVINE)	BDBM50120764 (CHEMBL149732 | Cyclopentanecarboxylic acid (2,7-di...) Show SMILES O=C(Nc1nc(nc2nc(cn12)-c1ccccc1)-c1ccccc1)C1CCCC1 Show InChI InChI=1S/C23H21N5O/c29-21(18-13-7-8-14-18)27-23-26-20(17-11-5-2-6-12-17)25-22-24-19(15-28(22)23)16-9-3-1-4-10-16/h1-6,9-12,15,18H,7-8,13-14H2,(H,24,25,26,27,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120767 (CHEMBL148464 | Cyclopentanecarboxylic acid (7-isop...) Show SMILES CC(C)c1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C20H23N5O/c1-13(2)16-12-25-19(21-16)22-17(14-8-4-3-5-9-14)23-20(25)24-18(26)15-10-6-7-11-15/h3-5,8-9,12-13,15H,6-7,10-11H2,1-2H3,(H,21,22,23,24,26)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17.4	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120763 (CHEMBL358076 | Cyclopentanecarboxylic acid (7-ethy...) Show SMILES CCc1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-2-15-12-24-18(20-15)21-16(13-8-4-3-5-9-13)22-19(24)23-17(25)14-10-6-7-11-14/h3-5,8-9,12,14H,2,6-7,10-11H2,1H3,(H,20,21,22,23,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	20.2	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120766 (CHEMBL147582 | N-(2,7-Diphenyl-imidazo[1,2-a][1,3,...) Show SMILES CC(=O)Nc1nc(nc2nc(cn12)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C19H15N5O/c1-13(25)20-18-22-17(15-10-6-3-7-11-15)23-19-21-16(12-24(18)19)14-8-4-2-5-9-14/h2-12H,1H3,(H,20,21,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	23	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM21217 (2-(4-methyl-1H-1,3-benzodiazol-2-yl)quinoxaline | ...) Show SMILES Cc1cccc2[nH]c(nc12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C16H12N4/c1-10-5-4-8-13-15(10)20-16(19-13)14-9-17-11-6-2-3-7-12(11)18-14/h2-9H,1H3,(H,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120759 (CHEMBL146479 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...) Show SMILES Cc1cn2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H15N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2-12H,1H3,(H,20,21,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	27.2	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120766 (CHEMBL147582 | N-(2,7-Diphenyl-imidazo[1,2-a][1,3,...) Show SMILES CC(=O)Nc1nc(nc2nc(cn12)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C19H15N5O/c1-13(25)20-18-22-17(15-10-6-3-7-11-15)23-19-21-16(12-24(18)19)14-8-4-2-5-9-14/h2-12H,1H3,(H,20,21,22,23,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	40	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120758 (CHEMBL148074 | Cyclopentyl-(7-methyl-2-phenyl-imid...) Show SMILES Cc1cn2c(NC3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C17H19N5/c1-12-11-22-16(18-12)20-15(13-7-3-2-4-8-13)21-17(22)19-14-9-5-6-10-14/h2-4,7-8,11,14H,5-6,9-10H2,1H3,(H,18,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	41	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179301 (2,5,8-triethyl-4,7-dihydro-1H-benzo[1,2-d:3,4-d':5...) Show SMILES CCc1nc2c([nH]1)c1nc(CC)[nH]c1c1nc(CC)[nH]c21 Show InChI InChI=1S/C15H18N6/c1-4-7-16-10-11(17-7)13-15(21-9(6-3)19-13)14-12(10)18-8(5-2)20-14/h4-6H2,1-3H3,(H,16,17)(H,18,20)(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM21215 (2-(1H-1,3-benzodiazol-2-yl)quinoxaline | 2-(1H-ben...) Show SMILES c1ccc2[nH]c(nc2c1)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H10N4/c1-2-6-11-10(5-1)16-9-14(17-11)15-18-12-7-3-4-8-13(12)19-15/h1-9H,(H,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	73	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179301 (2,5,8-triethyl-4,7-dihydro-1H-benzo[1,2-d:3,4-d':5...) Show SMILES CCc1nc2c([nH]1)c1nc(CC)[nH]c1c1nc(CC)[nH]c21 Show InChI InChI=1S/C15H18N6/c1-4-7-16-10-11(17-7)13-15(21-9(6-3)19-13)14-12(10)18-8(5-2)20-14/h4-6H2,1-3H3,(H,16,17)(H,18,20)(H,19,21)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	104	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120760 (CHEMBL343256 | Cyclohexanecarboxylic acid (7-methy...) Show SMILES Cc1cn2c(NC(=O)C3CCCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3,(H,20,21,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM21214 (3-(3-chloro-1H-pyrazol-5-yl)-1,2-dihydroquinoxalin...) Show SMILES Clc1cc(n[nH]1)-c1nc2ccccc2[nH]c1=O Show InChI InChI=1S/C11H7ClN4O/c12-9-5-8(15-16-9)10-11(17)14-7-4-2-1-3-6(7)13-10/h1-5H,(H,14,17)(H,15,16)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	125	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM21218 (2,5,8-trimethyl-4,7-dihydro-1H-benzo[1,2-d:3,4-d :...) Show SMILES Cc1nc2c([nH]1)c1nc(C)[nH]c1c1nc(C)[nH]c21 Show InChI InChI=1S/C12H12N6/c1-4-13-7-8(14-4)10-12(18-6(3)16-10)11-9(7)15-5(2)17-11/h1-3H3,(H,13,14)(H,15,17)(H,16,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179299 (2,5-diethyl-8-methyl-4,7-dihydro-1H-benzo[1,2-d:3,...) Show SMILES CCc1nc2c3nc(C)[nH]c3c3nc(CC)[nH]c3c2[nH]1 Show InChI InChI=1S/C14H16N6/c1-4-7-17-11-9-10(16-6(3)15-9)12-14(13(11)19-7)20-8(5-2)18-12/h4-5H2,1-3H3,(H,15,16)(H,17,19)(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	135	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179303 (2-(4-chloro-1H-benzo[d]imidazol-2-yl)quinoxaline |...) Show SMILES Clc1cccc2nc([nH]c12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H9ClN4/c16-9-4-3-7-12-14(9)20-15(19-12)13-8-17-10-5-1-2-6-11(10)18-13/h1-8H,(H,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179289 (2-ethyl-5,8-dimethyl-4,7-dihydro-1H-benzo[1,2-d:3,...) Show SMILES CCc1nc2c3[nH]c(C)nc3c3nc(C)[nH]c3c2[nH]1 Show InChI InChI=1S/C13H14N6/c1-4-7-18-12-10-8(14-5(2)16-10)9-11(13(12)19-7)17-6(3)15-9/h4H2,1-3H3,(H,14,16)(H,15,17)(H,18,19)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179295 (2-(1H-imidazo[4,5-c]pyridin-2-yl)quinoxaline | CHE...) Show SMILES c1ccc2nc(cnc2c1)-c1nc2ccncc2[nH]1 Show InChI InChI=1S/C14H9N5/c1-2-4-10-9(3-1)16-8-13(17-10)14-18-11-5-6-15-7-12(11)19-14/h1-8H,(H,18,19)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	168	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120760 (CHEMBL343256 | Cyclohexanecarboxylic acid (7-methy...) Show SMILES Cc1cn2c(NC(=O)C3CCCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3,(H,20,21,22,23,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	202	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120753 (CHEMBL421782 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...) Show SMILES CC(=O)Nc1nc(nc2nc(C)cn12)-c1ccccc1 Show InChI InChI=1S/C14H13N5O/c1-9-8-19-13(15-9)17-12(11-6-4-3-5-7-11)18-14(19)16-10(2)20/h3-8H,1-2H3,(H,15,16,17,18,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	231	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120754 (CHEMBL147913 | Cyclohexylmethyl-(7-methyl-2-phenyl...) Show SMILES Cc1cn2c(NCC3CCCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C19H23N5/c1-14-13-24-18(20-12-15-8-4-2-5-9-15)22-17(23-19(24)21-14)16-10-6-3-7-11-16/h3,6-7,10-11,13,15H,2,4-5,8-9,12H2,1H3,(H,20,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	231	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179304 (2-(6-chloro-4-methyl-1H-benzo[d]imidazol-2-yl)quin...) Show SMILES Cc1cc(Cl)cc2[nH]c(nc12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C16H11ClN4/c1-9-6-10(17)7-13-15(9)21-16(20-13)14-8-18-11-4-2-3-5-12(11)19-14/h2-8H,1H3,(H,20,21)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	238	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179306 (2-(4-(methylthio)-1H-benzo[d]imidazol-2-yl)quinoxa...) Show SMILES CSc1cccc2nc([nH]c12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C16H12N4S/c1-21-14-8-4-7-12-15(14)20-16(19-12)13-9-17-10-5-2-3-6-11(10)18-13/h2-9H,1H3,(H,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	278	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50179299 (2,5-diethyl-8-methyl-4,7-dihydro-1H-benzo[1,2-d:3,...) Show SMILES CCc1nc2c3nc(C)[nH]c3c3nc(CC)[nH]c3c2[nH]1 Show InChI InChI=1S/C14H16N6/c1-4-7-17-11-9-10(16-6(3)15-9)12-14(13(11)19-7)20-8(5-2)18-12/h4-5H2,1-3H3,(H,15,16)(H,17,19)(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	329	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120757 (7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-4-y...) Show SMILES Cc1cn2c(N)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C12H11N5/c1-8-7-17-11(13)15-10(16-12(17)14-8)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	PubMed	332	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM21173 (1,3-dipropyl-8-cyclopentylxanthine | 8-cyclopentyl...) Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1 Show InChI InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	337	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179303 (2-(4-chloro-1H-benzo[d]imidazol-2-yl)quinoxaline |...) Show SMILES Clc1cccc2nc([nH]c12)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H9ClN4/c16-9-4-3-7-12-14(9)20-15(19-12)13-8-17-10-5-1-2-6-11(10)18-13/h1-8H,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179307 (2-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)quinoxali...) Show SMILES Cc1cc2nc([nH]c2cc1C)-c1cnc2ccccc2n1 Show InChI InChI=1S/C17H14N4/c1-10-7-14-15(8-11(10)2)21-17(20-14)16-9-18-12-5-3-4-6-13(12)19-16/h3-9H,1-2H3,(H,20,21)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120761 (CHEMBL355898 | Cyclopentanecarboxylic acid (7-meth...) Show SMILES Cc1cn2c(NC(=O)C3CCCC3)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C18H19N5O/c1-12-11-23-17(19-12)20-15(13-7-3-2-4-8-13)21-18(23)22-16(24)14-9-5-6-10-14/h2-4,7-8,11,14H,5-6,9-10H2,1H3,(H,19,20,21,22,24)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	410	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179300 (7,8-Dihydro-3H,6H-5-thia-1,2,3,4,8a-pentaaza-cyclo...) Show SMILES O=c1n2CCCSc2nc2nn[nH]c12 Show InChI InChI=1S/C7H7N5OS/c13-6-4-5(10-11-9-4)8-7-12(6)2-1-3-14-7/h1-3H2,(H,9,10,11)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	437	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM21219 (12-methyl-10-thia-1,4,5,6,8-pentaazatricyclo[7.3.0...) Show SMILES CC1CSc2nc3nn[nH]c3c(=O)n12 Show InChI InChI=1S/C7H7N5OS/c1-3-2-14-7-8-5-4(9-11-10-5)6(13)12(3)7/h3H,2H2,1H3,(H,9,10,11)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50179289 (2-ethyl-5,8-dimethyl-4,7-dihydro-1H-benzo[1,2-d:3,...) Show SMILES CCc1nc2c3[nH]c(C)nc3c3nc(C)[nH]c3c2[nH]1 Show InChI InChI=1S/C13H14N6/c1-4-7-18-12-10-8(14-5(2)16-10)9-11(13(12)19-7)17-6(3)15-9/h4H2,1-3H3,(H,14,16)(H,15,17)(H,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	496	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (BOVINE)	BDBM50120770 (Adamantan-1-yl-(7-methyl-2-phenyl-imidazo[1,2-a][1...) Show SMILES Cc1cn2c(NC34C[C@H]5C[C@H](C[C@H](C5)C3)C4)nc(nc2n1)-c1ccccc1 |THB:11:10:7:12.14.13,11:12:7:10.15.9| Show InChI InChI=1S/C22H25N5/c1-14-13-27-20(23-14)24-19(18-5-3-2-4-6-18)25-21(27)26-22-10-15-7-16(11-22)9-17(8-15)12-22/h2-6,13,15-17H,7-12H2,1H3,(H,23,24,25,26)/t15-,16+,17-,22?	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	511	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]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120770 (Adamantan-1-yl-(7-methyl-2-phenyl-imidazo[1,2-a][1...) Show SMILES Cc1cn2c(NC34C[C@H]5C[C@H](C[C@H](C5)C3)C4)nc(nc2n1)-c1ccccc1 |THB:11:10:7:12.14.13,11:12:7:10.15.9| Show InChI InChI=1S/C22H25N5/c1-14-13-27-20(23-14)24-19(18-5-3-2-4-6-18)25-21(27)26-22-10-15-7-16(11-22)9-17(8-15)12-22/h2-6,13,15-17H,7-12H2,1H3,(H,23,24,25,26)/t15-,16+,17-,22?	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	526	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 [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM21215 (2-(1H-1,3-benzodiazol-2-yl)quinoxaline | 2-(1H-ben...) Show SMILES c1ccc2[nH]c(nc2c1)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H10N4/c1-2-6-11-10(5-1)16-9-14(17-11)15-18-12-7-3-4-8-13(12)19-15/h1-9H,(H,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	561	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50179302 (2-(5-chloro-1H-benzo[d]imidazol-2-yl)quinoxaline |...) Show SMILES Clc1ccc2nc([nH]c2c1)-c1cnc2ccccc2n1 Show InChI InChI=1S/C15H9ClN4/c16-9-5-6-12-13(7-9)20-15(19-12)14-8-17-10-3-1-2-4-11(10)18-14/h1-8H,(H,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	632	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli"Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 48: 8253-60 (2005) Article DOI: 10.1021/jm050792d BindingDB Entry DOI: 10.7270/Q2RF5VTX
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50120757 (7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-4-y...) Show SMILES Cc1cn2c(N)nc(nc2n1)-c1ccccc1 Show InChI InChI=1S/C12H11N5/c1-8-7-17-11(13)15-10(16-12(17)14-8)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	PubMed	682	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]- CGS-21,680 from Adenosine A2a receptor in bovine striatal membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair

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