Compile Data Set for Download or QSAR

Found 515 hits with Last Name = 'bharate' and Initial = 'ss'   

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))	BDBM50150078 (2-Amino-4-(3-hydroxy-phenyl)-6-(1H-imidazol-2-ylme...) Show SMILES Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2cccc(O)c2)c1C#N Show InChI InChI=1S/C17H12N6OS/c18-7-12-15(10-2-1-3-11(24)6-10)13(8-19)17(23-16(12)20)25-9-14-21-4-5-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from recombinant human adenosine A1 receptor expressed in CHO cell membrane by by scintillation counting method				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50150078 (2-Amino-4-(3-hydroxy-phenyl)-6-(1H-imidazol-2-ylme...) Show SMILES Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2cccc(O)c2)c1C#N Show InChI InChI=1S/C17H12N6OS/c18-7-12-15(10-2-1-3-11(24)6-10)13(8-19)17(23-16(12)20)25-9-14-21-4-5-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia 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
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from recombinant human adenosine A2A receptor expressed in HEK293 cell membrane by scintillation counting method				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189099 (CHEMBL3828479) Show SMILES COc1cc(Nc2nc3c(ncnc3s2)N2CCCC2)cc(OC)c1OC Show InChI InChI=1S/C18H21N5O3S/c1-24-12-8-11(9-13(25-2)15(12)26-3)21-18-22-14-16(23-6-4-5-7-23)19-10-20-17(14)27-18/h8-10H,4-7H2,1-3H3,(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia 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
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50150078 (2-Amino-4-(3-hydroxy-phenyl)-6-(1H-imidazol-2-ylme...) Show SMILES Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2cccc(O)c2)c1C#N Show InChI InChI=1S/C17H12N6OS/c18-7-12-15(10-2-1-3-11(24)6-10)13(8-19)17(23-16(12)20)25-9-14-21-4-5-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)	PDB 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
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [125I]I-ABMECA from recombinant human adenosine A3 receptor expressed in HEK293 cell membrane by scintillation counting method				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189097 (CHEMBL3827171) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3cccc(Br)c3)nc12 |r| Show InChI InChI=1S/C16H16BrN5OS/c17-10-3-1-4-11(7-10)20-16-21-13-14(18-9-19-15(13)24-16)22-6-2-5-12(22)8-23/h1,3-4,7,9,12,23H,2,5-6,8H2,(H,20,21)/t12-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	153	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189051 (CHEMBL3828082) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccccc3)nc12 |r| Show InChI InChI=1S/C16H17N5OS/c22-9-12-7-4-8-21(12)14-13-15(18-10-17-14)23-16(20-13)19-11-5-2-1-3-6-11/h1-3,5-6,10,12,22H,4,7-9H2,(H,19,20)/t12-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189104 (CHEMBL3827889) Show SMILES Brc1cccc(Nc2nc3c(ncnc3s2)N2CCCC2)c1 Show InChI InChI=1S/C15H14BrN5S/c16-10-4-3-5-11(8-10)19-15-20-12-13(21-6-1-2-7-21)17-9-18-14(12)22-15/h3-5,8-9H,1-2,6-7H2,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	245	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189056 (CHEMBL3828388) Show SMILES Cc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5OS/c1-11-4-6-12(7-5-11)20-17-21-14-15(18-10-19-16(14)24-17)22-8-2-3-13(22)9-23/h4-7,10,13,23H,2-3,8-9H2,1H3,(H,20,21)/t13-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	313	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189091 (CHEMBL3827396) Show SMILES COc1cc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc(OC)c1OC |r| Show InChI InChI=1S/C19H23N5O4S/c1-26-13-7-11(8-14(27-2)16(13)28-3)22-19-23-15-17(20-10-21-18(15)29-19)24-6-4-5-12(24)9-25/h7-8,10,12,25H,4-6,9H2,1-3H3,(H,22,23)/t12-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189103 (CHEMBL3088339) Show SMILES C1CN(CCO1)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C15H15N5OS/c1-2-4-11(5-3-1)18-15-19-12-13(16-10-17-14(12)22-15)20-6-8-21-9-7-20/h1-5,10H,6-9H2,(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	333	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189050 (CHEMBL3827207) Show SMILES C1CCN(C1)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C15H15N5S/c1-2-6-11(7-3-1)18-15-19-12-13(20-8-4-5-9-20)16-10-17-14(12)21-15/h1-3,6-7,10H,4-5,8-9H2,(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	351	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189056 (CHEMBL3828388) Show SMILES Cc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5OS/c1-11-4-6-12(7-5-11)20-17-21-14-15(18-10-19-16(14)24-17)22-8-2-3-13(22)9-23/h4-7,10,13,23H,2-3,8-9H2,1H3,(H,20,21)/t13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	399	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189053 (CHEMBL3828238) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccc(Cl)cc3)nc12 |r| Show InChI InChI=1S/C16H16ClN5OS/c17-10-3-5-11(6-4-10)20-16-21-13-14(18-9-19-15(13)24-16)22-7-1-2-12(22)8-23/h3-6,9,12,23H,1-2,7-8H2,(H,20,21)/t12-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	466	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189097 (CHEMBL3827171) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3cccc(Br)c3)nc12 |r| Show InChI InChI=1S/C16H16BrN5OS/c17-10-3-1-4-11(7-10)20-16-21-13-14(18-9-19-15(13)24-16)22-6-2-5-12(22)8-23/h1,3-4,7,9,12,23H,2,5-6,8H2,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189051 (CHEMBL3828082) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccccc3)nc12 |r| Show InChI InChI=1S/C16H17N5OS/c22-9-12-7-4-8-21(12)14-13-15(18-10-17-14)23-16(20-13)19-11-5-2-1-3-6-11/h1-3,5-6,10,12,22H,4,7-9H2,(H,19,20)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	555	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189055 (CHEMBL3828214) Show SMILES Cc1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1 Show InChI InChI=1S/C16H17N5S/c1-11-4-6-12(7-5-11)19-16-20-13-14(21-8-2-3-9-21)17-10-18-15(13)22-16/h4-7,10H,2-3,8-9H2,1H3,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	563	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189054 (CHEMBL3828306) Show SMILES COc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5O2S/c1-24-13-6-4-11(5-7-13)20-17-21-14-15(18-10-19-16(14)25-17)22-8-2-3-12(22)9-23/h4-7,10,12,23H,2-3,8-9H2,1H3,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	594	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189053 (CHEMBL3828238) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccc(Cl)cc3)nc12 |r| Show InChI InChI=1S/C16H16ClN5OS/c17-10-3-5-11(6-4-10)20-16-21-13-14(18-9-19-15(13)24-16)22-7-1-2-12(22)8-23/h3-6,9,12,23H,1-2,7-8H2,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	629	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189054 (CHEMBL3828306) Show SMILES COc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5O2S/c1-24-13-6-4-11(5-7-13)20-17-21-14-15(18-10-19-16(14)25-17)22-8-2-3-12(22)9-23/h4-7,10,12,23H,2-3,8-9H2,1H3,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	713	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189056 (CHEMBL3828388) Show SMILES Cc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5OS/c1-11-4-6-12(7-5-11)20-17-21-14-15(18-10-19-16(14)24-17)22-8-2-3-13(22)9-23/h4-7,10,13,23H,2-3,8-9H2,1H3,(H,20,21)/t13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	843	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189053 (CHEMBL3828238) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccc(Cl)cc3)nc12 |r| Show InChI InChI=1S/C16H16ClN5OS/c17-10-3-5-11(6-4-10)20-16-21-13-14(18-9-19-15(13)24-16)22-7-1-2-12(22)8-23/h3-6,9,12,23H,1-2,7-8H2,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	934	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189091 (CHEMBL3827396) Show SMILES COc1cc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc(OC)c1OC |r| Show InChI InChI=1S/C19H23N5O4S/c1-26-13-7-11(8-14(27-2)16(13)28-3)22-19-23-15-17(20-10-21-18(15)29-19)24-6-4-5-12(24)9-25/h7-8,10,12,25H,4-6,9H2,1-3H3,(H,22,23)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	974	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189055 (CHEMBL3828214) Show SMILES Cc1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1 Show InChI InChI=1S/C16H17N5S/c1-11-4-6-12(7-5-11)19-16-20-13-14(21-8-2-3-9-21)17-10-18-15(13)22-16/h4-7,10H,2-3,8-9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	974	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189051 (CHEMBL3828082) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccccc3)nc12 |r| Show InChI InChI=1S/C16H17N5OS/c22-9-12-7-4-8-21(12)14-13-15(18-10-17-14)23-16(20-13)19-11-5-2-1-3-6-11/h1-3,5-6,10,12,22H,4,7-9H2,(H,19,20)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	978	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189119 (CHEMBL3088340) Show SMILES C1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C16H17N5S/c1-3-7-12(8-4-1)19-16-20-13-14(17-11-18-15(13)22-16)21-9-5-2-6-10-21/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	980	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189175 (CHEMBL3828590) Show SMILES Clc1ncnc2sc(nc12)N(Cc1ccccc1)C(=S)NCc1ccccc1 Show InChI InChI=1S/C20H16ClN5S2/c21-17-16-18(24-13-23-17)28-20(25-16)26(12-15-9-5-2-6-10-15)19(27)22-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H,22,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189066 (CHEMBL3827097) Show SMILES COc1cc(Nc2nc3c(Cl)ncnc3s2)cc(OC)c1OC Show InChI InChI=1S/C14H13ClN4O3S/c1-20-8-4-7(5-9(21-2)11(8)22-3)18-14-19-10-12(15)16-6-17-13(10)23-14/h4-6H,1-3H3,(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	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189097 (CHEMBL3827171) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3cccc(Br)c3)nc12 |r| Show InChI InChI=1S/C16H16BrN5OS/c17-10-3-1-4-11(7-10)20-16-21-13-14(18-9-19-15(13)24-16)22-6-2-5-12(22)8-23/h1,3-4,7,9,12,23H,2,5-6,8H2,(H,20,21)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189054 (CHEMBL3828306) Show SMILES COc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r| Show InChI InChI=1S/C17H19N5O2S/c1-24-13-6-4-11(5-7-13)20-17-21-14-15(18-10-19-16(14)25-17)22-8-2-3-12(22)9-23/h4-7,10,12,23H,2-3,8-9H2,1H3,(H,20,21)/t12-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.11E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189100 (CHEMBL3088342) Show SMILES CN(C)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C13H13N5S/c1-18(2)11-10-12(15-8-14-11)19-13(17-10)16-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.27E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189100 (CHEMBL3088342) Show SMILES CN(C)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C13H13N5S/c1-18(2)11-10-12(15-8-14-11)19-13(17-10)16-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189099 (CHEMBL3828479) Show SMILES COc1cc(Nc2nc3c(ncnc3s2)N2CCCC2)cc(OC)c1OC Show InChI InChI=1S/C18H21N5O3S/c1-24-12-8-11(9-13(25-2)15(12)26-3)21-18-22-14-16(23-6-4-5-7-23)19-10-20-17(14)27-18/h8-10H,4-7H2,1-3H3,(H,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189104 (CHEMBL3827889) Show SMILES Brc1cccc(Nc2nc3c(ncnc3s2)N2CCCC2)c1 Show InChI InChI=1S/C15H14BrN5S/c16-10-4-3-5-11(8-10)19-15-20-12-13(21-6-1-2-7-21)17-9-18-14(12)22-15/h3-5,8-9H,1-2,6-7H2,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189095 (CHEMBL3088347) Show SMILES Clc1ccc(Nc2nc3c(ncnc3s2)N2CCOCC2)cc1 Show InChI InChI=1S/C15H14ClN5OS/c16-10-1-3-11(4-2-10)19-15-20-12-13(17-9-18-14(12)23-15)21-5-7-22-8-6-21/h1-4,9H,5-8H2,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189091 (CHEMBL3827396) Show SMILES COc1cc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc(OC)c1OC |r| Show InChI InChI=1S/C19H23N5O4S/c1-26-13-7-11(8-14(27-2)16(13)28-3)22-19-23-15-17(20-10-21-18(15)29-19)24-6-4-5-12(24)9-25/h7-8,10,12,25H,4-6,9H2,1-3H3,(H,22,23)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.46E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189102 (CHEMBL3088338) Show SMILES Clc1ncnc2sc(NC(=O)c3ccccc3)nc12 Show InChI InChI=1S/C12H7ClN4OS/c13-9-8-11(15-6-14-9)19-12(16-8)17-10(18)7-4-2-1-3-5-7/h1-6H,(H,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189178 (CHEMBL3088335) Show SMILES Clc1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C11H7ClN4S/c12-9-8-10(14-6-13-9)17-11(16-8)15-7-4-2-1-3-5-7/h1-6H,(H,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.52E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189175 (CHEMBL3828590) Show SMILES Clc1ncnc2sc(nc12)N(Cc1ccccc1)C(=S)NCc1ccccc1 Show InChI InChI=1S/C20H16ClN5S2/c21-17-16-18(24-13-23-17)28-20(25-16)26(12-15-9-5-2-6-10-15)19(27)22-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H,22,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.87E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189052 (CHEMBL3088334) Show SMILES Clc1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1 Show InChI InChI=1S/C15H14ClN5S/c16-10-3-5-11(6-4-10)19-15-20-12-13(21-7-1-2-8-21)17-9-18-14(12)22-15/h3-6,9H,1-2,7-8H2,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189098 (CHEMBL3088341) Show SMILES CCN(CC)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C15H17N5S/c1-3-20(4-2)13-12-14(17-10-16-13)21-15(19-12)18-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3,(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	2.21E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189058 (CHEMBL3827582) Show SMILES Fc1cccc(F)c1Nc1nc2c(ncnc2s1)N1CCCC1 Show InChI InChI=1S/C15H13F2N5S/c16-9-4-3-5-10(17)11(9)20-15-21-12-13(22-6-1-2-7-22)18-8-19-14(12)23-15/h3-5,8H,1-2,6-7H2,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50189058 (CHEMBL3827582) Show SMILES Fc1cccc(F)c1Nc1nc2c(ncnc2s1)N1CCCC1 Show InChI InChI=1S/C15H13F2N5S/c16-9-4-3-5-10(17)11(9)20-15-21-12-13(22-6-1-2-7-22)18-8-19-14(12)23-15/h3-5,8H,1-2,6-7H2,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting ...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189066 (CHEMBL3827097) Show SMILES COc1cc(Nc2nc3c(Cl)ncnc3s2)cc(OC)c1OC Show InChI InChI=1S/C14H13ClN4O3S/c1-20-8-4-7(5-9(21-2)11(8)22-3)18-14-19-10-12(15)16-6-17-13(10)23-14/h4-6H,1-3H3,(H,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.65E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189101 (CHEMBL3088337) Show SMILES Clc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1 Show InChI InChI=1S/C11H6Cl2N4S/c12-6-1-3-7(4-2-6)16-11-17-8-9(13)14-5-15-10(8)18-11/h1-5H,(H,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189096 (CHEMBL3088343) Show SMILES CN1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12 Show InChI InChI=1S/C16H18N6S/c1-21-7-9-22(10-8-21)14-13-15(18-11-17-14)23-16(20-13)19-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.84E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189064 (CHEMBL3828047) Show SMILES Clc1ncnc2sc(Nc3cccc(Br)c3)nc12 Show InChI InChI=1S/C11H6BrClN4S/c12-6-2-1-3-7(4-6)16-11-17-8-9(13)14-5-15-10(8)18-11/h1-5H,(H,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.96E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189057 (CHEMBL3827990) Show SMILES [O-][N+](=O)c1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1 Show InChI InChI=1S/C15H14N6O2S/c22-21(23)11-5-3-10(4-6-11)18-15-19-12-13(20-7-1-2-8-20)16-9-17-14(12)24-15/h3-6,9H,1-2,7-8H2,(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	3.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189058 (CHEMBL3827582) Show SMILES Fc1cccc(F)c1Nc1nc2c(ncnc2s1)N1CCCC1 Show InChI InChI=1S/C15H13F2N5S/c16-9-4-3-5-10(17)11(9)20-15-21-12-13(22-6-1-2-7-22)18-8-19-14(12)23-15/h3-5,8H,1-2,6-7H2,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.19E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50189059 (CHEMBL3828448) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3c(F)cccc3F)nc12 |r| Show InChI InChI=1S/C16H15F2N5OS/c17-10-4-1-5-11(18)12(10)21-16-22-13-14(19-8-20-15(13)25-16)23-6-2-3-9(23)7-24/h1,4-5,8-9,24H,2-3,6-7H2,(H,21,22)/t9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]NECA from recombinant human adenosine A2A receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation counting...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189059 (CHEMBL3828448) Show SMILES OC[C@@H]1CCCN1c1ncnc2sc(Nc3c(F)cccc3F)nc12 |r| Show InChI InChI=1S/C16H15F2N5OS/c17-10-4-1-5-11(18)12(10)21-16-22-13-14(19-8-20-15(13)25-16)23-6-2-3-9(23)7-24/h1,4-5,8-9,24H,2-3,6-7H2,(H,21,22)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Displacement of [3H]HEMADO from recombinant human adenosine A3 receptor expressed in CHO cell membrane after 3 hrs by microbeta scintillation countin...				J Med Chem 59: 5922-8 (2016) Article DOI: 10.1021/acs.jmedchem.6b00552 BindingDB Entry DOI: 10.7270/Q2P84DV8
					More data for this Ligand-Target Pair

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