Found 129 hits of Enzyme Inhibition Constant Data 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 A3
(Homo sapiens (Human)) | BDBM50109461
(1-(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,...)Show SMILES Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1 Show InChI InChI=1S/C18H14N8O2/c1-25-10-12-14(23-25)21-17(22-18(27)19-11-6-3-2-4-7-11)26-16(12)20-15(24-26)13-8-5-9-28-13/h2-10H,1H3,(H2,19,21,22,23,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]MRE3008-F20 from human A3 receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137528
(CHEMBL3752514)Show InChI InChI=1S/C15H13N7O/c16-13-19-14(17-9-10-5-2-1-3-6-10)20-15-18-12(21-22(13)15)11-7-4-8-23-11/h1-8H,9H2,(H3,16,17,18,19,20,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137521
(CHEMBL3752621)Show SMILES O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H18N8O2/c31-22(24-16-10-5-2-6-11-16)28-21-27-19(23-14-15-8-3-1-4-9-15)26-20-25-18(29-30(20)21)17-12-7-13-32-17/h1-13H,14H2,(H3,23,24,25,26,27,28,29,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50094701
(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]t...)Show InChI InChI=1S/C11H9N7O/c1-17-5-6-8(15-17)14-11(12)18-10(6)13-9(16-18)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14,15) | 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
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH58261 from human A2A receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137527
(CHEMBL3752431)Show InChI InChI=1S/C14H17N7O/c15-12-18-13(16-9-5-2-1-3-6-9)19-14-17-11(20-21(12)14)10-7-4-8-22-10/h4,7-9H,1-3,5-6H2,(H3,15,16,17,18,19,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137530
(CHEMBL3753079)Show SMILES O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C23H19N7O2/c31-19(14-16-8-3-1-4-9-16)25-22-27-21(24-15-17-10-5-2-6-11-17)28-23-26-20(29-30(22)23)18-12-7-13-32-18/h1-13H,14-15H2,(H2,24,25,26,27,28,29,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137522
(CHEMBL3753012)Show SMILES O=C(Nc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H22N8O2/c30-21(23-15-10-5-2-6-11-15)27-20-26-18(22-14-8-3-1-4-9-14)25-19-24-17(28-29(19)20)16-12-7-13-31-16/h2,5-7,10-14H,1,3-4,8-9H2,(H3,22,23,24,25,26,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137630
(CHEMBL3753690)Show SMILES C(Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H23N7O/c1-3-8-15(9-4-1)14-22-19-25-20(23-16-10-5-2-6-11-16)28-21(26-19)24-18(27-28)17-12-7-13-29-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,22,23,24,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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 |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137633
(CHEMBL3754573)Show SMILES C(Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H19N7O/c1-3-8-16(9-4-1)14-23-20-26-21(24-15-17-10-5-2-6-11-17)29-22(27-20)25-19(28-29)18-12-7-13-30-18/h1-13H,14-15H2,(H2,23,24,25,26,27,28) | 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
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137636
(CHEMBL3752432)Show SMILES Fc1ccc(CNc2nc(NCc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C22H18FN7O/c23-17-10-8-16(9-11-17)14-25-21-27-20(24-13-15-5-2-1-3-6-15)28-22-26-19(29-30(21)22)18-7-4-12-31-18/h1-12H,13-14H2,(H2,24,25,26,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137529
(CHEMBL3754417)Show SMILES O=C(Cc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H23N7O2/c30-18(14-15-8-3-1-4-9-15)24-21-26-20(23-16-10-5-2-6-11-16)27-22-25-19(28-29(21)22)17-12-7-13-31-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,23,24,25,26,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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 |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM21190
(4-(2-{[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-...)Show InChI InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]ZM-241385 from human A2B receptor expressed in HEK-293 cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137521
(CHEMBL3752621)Show SMILES O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H18N8O2/c31-22(24-16-10-5-2-6-11-16)28-21-27-19(23-14-15-8-3-1-4-9-15)26-20-25-18(29-30(20)21)17-12-7-13-32-17/h1-13H,14H2,(H3,23,24,25,26,27,28,29,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137528
(CHEMBL3752514)Show InChI InChI=1S/C15H13N7O/c16-13-19-14(17-9-10-5-2-1-3-6-10)20-15-18-12(21-22(13)15)11-7-4-8-23-11/h1-8H,9H2,(H3,16,17,18,19,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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 |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137633
(CHEMBL3754573)Show SMILES C(Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H19N7O/c1-3-8-16(9-4-1)14-23-20-26-21(24-15-17-10-5-2-6-11-17)29-22(27-20)25-19(28-29)18-12-7-13-30-18/h1-13H,14-15H2,(H2,23,24,25,26,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137637
(CHEMBL3754080)Show SMILES Fc1ccc(CNc2nc(NCc3ccc(F)cc3)n3nc(nc3n2)-c2ccco2)cc1 Show InChI InChI=1S/C22H17F2N7O/c23-16-7-3-14(4-8-16)12-25-20-28-21(26-13-15-5-9-17(24)10-6-15)31-22(29-20)27-19(30-31)18-2-1-11-32-18/h1-11H,12-13H2,(H2,25,26,27,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137530
(CHEMBL3753079)Show SMILES O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C23H19N7O2/c31-19(14-16-8-3-1-4-9-16)25-22-27-21(24-15-17-10-5-2-6-11-17)28-23-26-20(29-30(22)23)18-12-7-13-32-18/h1-13H,14-15H2,(H2,24,25,26,27,28,29,31) | 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 Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137525
(CHEMBL3752868)Show InChI InChI=1S/C9H9N7O/c1-11-8-13-7(10)16-9(14-8)12-6(15-16)5-3-2-4-17-5/h2-4H,1H3,(H3,10,11,12,13,14,15) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137630
(CHEMBL3753690)Show SMILES C(Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H23N7O/c1-3-8-15(9-4-1)14-22-19-25-20(23-16-10-5-2-6-11-16)28-21(26-19)24-18(27-28)17-12-7-13-29-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,22,23,24,25,26,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 64 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137526
(CHEMBL3754099)Show InChI InChI=1S/C11H13N7O/c1-6(2)13-10-15-9(12)18-11(16-10)14-8(17-18)7-4-3-5-19-7/h3-6H,1-2H3,(H3,12,13,14,15,16,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137636
(CHEMBL3752432)Show SMILES Fc1ccc(CNc2nc(NCc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C22H18FN7O/c23-17-10-8-16(9-11-17)14-25-21-27-20(24-13-15-5-2-1-3-6-15)28-22-26-19(29-30(21)22)18-7-4-12-31-18/h1-12H,13-14H2,(H2,24,25,26,27,28,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 75 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137523
(CHEMBL3754685)Show SMILES CC(C)Nc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H18N8O2/c1-11(2)19-15-22-16-21-14(13-9-6-10-28-13)25-26(16)17(23-15)24-18(27)20-12-7-4-3-5-8-12/h3-11H,1-2H3,(H3,19,20,21,22,23,24,25,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 87 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50094701
(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]t...)Show InChI InChI=1S/C11H9N7O/c1-17-5-6-8(15-17)14-11(12)18-10(6)13-9(16-18)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14,15) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]DPCPX from human A2B receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137517
(CHEMBL3752342)Show SMILES O=C(Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H17N7O2/c30-19(16-10-5-2-6-11-16)25-22-27-20(23-14-15-8-3-1-4-9-15)26-21-24-18(28-29(21)22)17-12-7-13-31-17/h1-13H,14H2,(H2,23,24,25,26,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 95 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137528
(CHEMBL3752514)Show InChI InChI=1S/C15H13N7O/c16-13-19-14(17-9-10-5-2-1-3-6-10)20-15-18-12(21-22(13)15)11-7-4-8-23-11/h1-8H,9H2,(H3,16,17,18,19,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 95 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137524
(CHEMBL3754353)Show InChI InChI=1S/C16H14N8O2/c1-17-13-20-14-19-12(11-8-5-9-26-11)23-24(14)15(21-13)22-16(25)18-10-6-3-2-4-7-10/h2-9H,1H3,(H3,17,18,19,20,21,22,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50094701
(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]t...)Show InChI InChI=1S/C11H9N7O/c1-17-5-6-8(15-17)14-11(12)18-10(6)13-9(16-18)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 101 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]DPCPX from human A1 receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137535
(CHEMBL3753698)Show InChI InChI=1S/C17H23N7O/c1-11(2)18-15-21-16(19-12-7-4-3-5-8-12)24-17(22-15)20-14(23-24)13-9-6-10-25-13/h6,9-12H,3-5,7-8H2,1-2H3,(H2,18,19,20,21,22,23) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 105 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137635
(CHEMBL3754124)Show SMILES Fc1ccc(CNc2nc(NC3CCCCC3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H22FN7O/c22-15-10-8-14(9-11-15)13-23-20-26-19(24-16-5-2-1-3-6-16)27-21-25-18(28-29(20)21)17-7-4-12-30-17/h4,7-12,16H,1-3,5-6,13H2,(H2,23,24,25,26,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 112 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137531
(CHEMBL3753118)Show SMILES C1CCC(CC1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C20H20N6O2/c1-3-8-14(9-4-1)21-18-23-20(28-15-10-5-2-6-11-15)24-19-22-17(25-26(18)19)16-12-7-13-27-16/h2,5-7,10-14H,1,3-4,8-9H2,(H,21,22,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 113 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137632
(CHEMBL3754718)Show InChI InChI=1S/C18H19N7O/c1-12(2)20-16-22-17(19-11-13-7-4-3-5-8-13)25-18(23-16)21-15(24-25)14-9-6-10-26-14/h3-10,12H,11H2,1-2H3,(H2,19,20,21,22,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 114 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137637
(CHEMBL3754080)Show SMILES Fc1ccc(CNc2nc(NCc3ccc(F)cc3)n3nc(nc3n2)-c2ccco2)cc1 Show InChI InChI=1S/C22H17F2N7O/c23-16-7-3-14(4-8-16)12-25-20-28-21(26-13-15-5-9-17(24)10-6-15)31-22(29-20)27-19(30-31)18-2-1-11-32-18/h1-11H,12-13H2,(H2,25,26,27,28,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 123 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137536
(CHEMBL3753384)Show SMILES C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C20H27N7O/c1-3-8-14(9-4-1)21-18-24-19(22-15-10-5-2-6-11-15)27-20(25-18)23-17(26-27)16-12-7-13-28-16/h7,12-15H,1-6,8-11H2,(H2,21,22,23,24,25,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 129 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137527
(CHEMBL3752431)Show InChI InChI=1S/C14H17N7O/c15-12-18-13(16-9-5-2-1-3-6-9)19-14-17-11(20-21(12)14)10-7-4-8-22-10/h4,7-9H,1-3,5-6H2,(H3,15,16,17,18,19,20) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 138 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137534
(CHEMBL3754333)Show InChI InChI=1S/C15H19N7O/c1-16-13-19-14(17-10-6-3-2-4-7-10)22-15(20-13)18-12(21-22)11-8-5-9-23-11/h5,8-10H,2-4,6-7H2,1H3,(H2,16,17,18,19,20,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 143 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137523
(CHEMBL3754685)Show SMILES CC(C)Nc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H18N8O2/c1-11(2)19-15-22-16-21-14(13-9-6-10-28-13)25-26(16)17(23-15)24-18(27)20-12-7-4-3-5-8-12/h3-11H,1-2H3,(H3,19,20,21,22,23,24,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137631
(CHEMBL3754336)Show InChI InChI=1S/C16H15N7O/c1-17-14-20-15(18-10-11-6-3-2-4-7-11)23-16(21-14)19-13(22-23)12-8-5-9-24-12/h2-9H,10H2,1H3,(H2,17,18,19,20,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 173 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137536
(CHEMBL3753384)Show SMILES C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C20H27N7O/c1-3-8-14(9-4-1)21-18-24-19(22-15-10-5-2-6-11-15)27-20(25-18)23-17(26-27)16-12-7-13-28-16/h7,12-15H,1-6,8-11H2,(H2,21,22,23,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 177 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137520
(CHEMBL3753604)Show InChI InChI=1S/C16H13N7O2/c1-17-14-20-15-18-12(11-8-5-9-25-11)22-23(15)16(21-14)19-13(24)10-6-3-2-4-7-10/h2-9H,1H3,(H2,17,18,19,20,21,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 194 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50109461
(1-(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,...)Show SMILES Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1 Show InChI InChI=1S/C18H14N8O2/c1-25-10-12-14(23-25)21-17(22-18(27)19-11-6-3-2-4-7-11)26-16(12)20-15(24-26)13-8-5-9-28-13/h2-10H,1H3,(H2,19,21,22,23,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 222 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]DPCPX from human A2B receptor expressed in HEK293 cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137634
(CHEMBL3752753)Show InChI InChI=1S/C16H14FN7O/c1-18-14-21-15(19-9-10-4-6-11(17)7-5-10)24-16(22-14)20-13(23-24)12-3-2-8-25-12/h2-8H,9H2,1H3,(H2,18,19,20,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 235 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137517
(CHEMBL3752342)Show SMILES O=C(Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H17N7O2/c30-19(16-10-5-2-6-11-16)25-22-27-20(23-14-15-8-3-1-4-9-15)26-21-24-18(28-29(21)22)17-12-7-13-31-17/h1-13H,14H2,(H2,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137515
(CHEMBL3752488)Show SMILES CC(C)Nc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C19H19N7O2/c1-12(2)20-17-23-18(21-15(27)11-13-7-4-3-5-8-13)26-19(24-17)22-16(25-26)14-9-6-10-28-14/h3-10,12H,11H2,1-2H3,(H2,20,21,22,23,24,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 257 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137631
(CHEMBL3754336)Show InChI InChI=1S/C16H15N7O/c1-17-14-20-15(18-10-11-6-3-2-4-7-11)23-16(21-14)19-13(22-23)12-8-5-9-24-12/h2-9H,10H2,1H3,(H2,17,18,19,20,21,22) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 275 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137529
(CHEMBL3754417)Show SMILES O=C(Cc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H23N7O2/c30-18(14-15-8-3-1-4-9-15)24-21-26-20(23-16-10-5-2-6-11-16)27-22-25-19(28-29(21)22)17-12-7-13-31-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 286 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137531
(CHEMBL3753118)Show SMILES C1CCC(CC1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C20H20N6O2/c1-3-8-14(9-4-1)21-18-23-20(28-15-10-5-2-6-11-15)24-19-22-17(25-26(18)19)16-12-7-13-27-16/h2,5-7,10-14H,1,3-4,8-9H2,(H,21,22,23,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 294 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50094701
(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]t...)Show InChI InChI=1S/C11H9N7O/c1-17-5-6-8(15-17)14-11(12)18-10(6)13-9(16-18)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]MRE3008-F20 from human A3 receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137516
(CHEMBL3754704)Show InChI InChI=1S/C17H15N7O2/c1-18-15-21-16(19-13(25)10-11-6-3-2-4-7-11)24-17(22-15)20-14(23-24)12-8-5-9-26-12/h2-9H,10H2,1H3,(H2,18,19,20,21,22,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137536
(CHEMBL3753384)Show SMILES C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C20H27N7O/c1-3-8-14(9-4-1)21-18-24-19(22-15-10-5-2-6-11-15)27-20(25-18)23-17(26-27)16-12-7-13-28-16/h7,12-15H,1-6,8-11H2,(H2,21,22,23,24,25,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 306 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137521
(CHEMBL3752621)Show SMILES O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H18N8O2/c31-22(24-16-10-5-2-6-11-16)28-21-27-19(23-14-15-8-3-1-4-9-15)26-20-25-18(29-30(20)21)17-12-7-13-32-17/h1-13H,14H2,(H3,23,24,25,26,27,28,29,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 311 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137522
(CHEMBL3753012)Show SMILES O=C(Nc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H22N8O2/c30-21(23-15-10-5-2-6-11-15)27-20-26-18(22-14-8-3-1-4-9-14)25-19-24-17(28-29(19)20)16-12-7-13-31-16/h2,5-7,10-14H,1,3-4,8-9H2,(H3,22,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 349 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137534
(CHEMBL3754333)Show InChI InChI=1S/C15H19N7O/c1-16-13-19-14(17-10-6-3-2-4-7-10)22-15(20-13)18-12(21-22)11-8-5-9-23-11/h5,8-10H,2-4,6-7H2,1H3,(H2,16,17,18,19,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 361 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137527
(CHEMBL3752431)Show InChI InChI=1S/C14H17N7O/c15-12-18-13(16-9-5-2-1-3-6-9)19-14-17-11(20-21(12)14)10-7-4-8-22-10/h4,7-9H,1-3,5-6H2,(H3,15,16,17,18,19,20) | PDB
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 Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137532
(CHEMBL3752965)Show SMILES C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H16N6O2/c1-3-8-15(9-4-1)14-22-19-24-21(29-16-10-5-2-6-11-16)25-20-23-18(26-27(19)20)17-12-7-13-28-17/h1-13H,14H2,(H,22,23,24,25,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 375 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50109461
(1-(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,...)Show SMILES Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1 Show InChI InChI=1S/C18H14N8O2/c1-25-10-12-14(23-25)21-17(22-18(27)19-11-6-3-2-4-7-11)26-16(12)20-15(24-26)13-8-5-9-28-13/h2-10H,1H3,(H2,19,21,22,23,27) | 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
| 381 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]ZM-241385 from human A2A receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137515
(CHEMBL3752488)Show SMILES CC(C)Nc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C19H19N7O2/c1-12(2)20-17-23-18(21-15(27)11-13-7-4-3-5-8-13)26-19(24-17)22-16(25-26)14-9-6-10-28-14/h3-10,12H,11H2,1-2H3,(H2,20,21,22,23,24,25,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 393 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137632
(CHEMBL3754718)Show InChI InChI=1S/C18H19N7O/c1-12(2)20-16-22-17(19-11-13-7-4-3-5-8-13)25-18(23-16)21-15(24-25)14-9-6-10-26-14/h3-10,12H,11H2,1-2H3,(H2,19,20,21,22,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 394 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137535
(CHEMBL3753698)Show InChI InChI=1S/C17H23N7O/c1-11(2)18-15-21-16(19-12-7-4-3-5-8-12)24-17(22-15)20-14(23-24)13-9-6-10-25-13/h6,9-12H,3-5,7-8H2,1-2H3,(H2,18,19,20,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 397 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137630
(CHEMBL3753690)Show SMILES C(Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H23N7O/c1-3-8-15(9-4-1)14-22-19-25-20(23-16-10-5-2-6-11-16)28-21(26-19)24-18(27-28)17-12-7-13-29-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,22,23,24,25,26,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 455 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137634
(CHEMBL3752753)Show InChI InChI=1S/C16H14FN7O/c1-18-14-21-15(19-9-10-4-6-11(17)7-5-10)24-16(22-14)20-13(23-24)12-3-2-8-25-12/h2-8H,9H2,1H3,(H2,18,19,20,21,22,23) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 557 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137532
(CHEMBL3752965)Show SMILES C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H16N6O2/c1-3-8-15(9-4-1)14-22-19-24-21(29-16-10-5-2-6-11-16)25-20-23-18(26-27(19)20)17-12-7-13-28-17/h1-13H,14H2,(H,22,23,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137526
(CHEMBL3754099)Show InChI InChI=1S/C11H13N7O/c1-6(2)13-10-15-9(12)18-11(16-10)14-8(17-18)7-4-3-5-19-7/h3-6H,1-2H3,(H3,12,13,14,15,16,17) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 568 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137524
(CHEMBL3754353)Show InChI InChI=1S/C16H14N8O2/c1-17-13-20-14-19-12(11-8-5-9-26-11)23-24(14)15(21-13)22-16(25)18-10-6-3-2-4-7-10/h2-9H,1H3,(H3,17,18,19,20,21,22,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 572 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50109461
(1-(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,...)Show SMILES Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1 Show InChI InChI=1S/C18H14N8O2/c1-25-10-12-14(23-25)21-17(22-18(27)19-11-6-3-2-4-7-11)26-16(12)20-15(24-26)13-8-5-9-28-13/h2-10H,1H3,(H2,19,21,22,23,27) | 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 |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]DPCPX from human A1 receptor expressed in CHO cells by scintillation counter |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137530
(CHEMBL3753079)Show SMILES O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C23H19N7O2/c31-19(14-16-8-3-1-4-9-16)25-22-27-21(24-15-17-10-5-2-6-11-17)28-23-26-20(29-30(22)23)18-12-7-13-32-18/h1-13H,14-15H2,(H2,24,25,26,27,28,29,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 676 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137531
(CHEMBL3753118)Show SMILES C1CCC(CC1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C20H20N6O2/c1-3-8-14(9-4-1)21-18-23-20(28-15-10-5-2-6-11-15)24-19-22-17(25-26(18)19)16-12-7-13-27-16/h2,5-7,10-14H,1,3-4,8-9H2,(H,21,22,23,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 757 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137633
(CHEMBL3754573)Show SMILES C(Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H19N7O/c1-3-8-16(9-4-1)14-23-20-26-21(24-15-17-10-5-2-6-11-17)29-22(27-20)25-19(28-29)18-12-7-13-30-18/h1-13H,14-15H2,(H2,23,24,25,26,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 784 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137535
(CHEMBL3753698)Show InChI InChI=1S/C17H23N7O/c1-11(2)18-15-21-16(19-12-7-4-3-5-8-12)24-17(22-15)20-14(23-24)13-9-6-10-25-13/h6,9-12H,3-5,7-8H2,1-2H3,(H2,18,19,20,21,22,23) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 801 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137533
(CHEMBL3753103)Show SMILES Fc1ccc(CNc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H15FN6O2/c22-15-10-8-14(9-11-15)13-23-19-25-21(30-16-5-2-1-3-6-16)26-20-24-18(27-28(19)20)17-7-4-12-29-17/h1-12H,13H2,(H,23,24,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 905 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137534
(CHEMBL3754333)Show InChI InChI=1S/C15H19N7O/c1-16-13-19-14(17-10-6-3-2-4-7-10)22-15(20-13)18-12(21-22)11-8-5-9-23-11/h5,8-10H,2-4,6-7H2,1H3,(H2,16,17,18,19,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 905 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137522
(CHEMBL3753012)Show SMILES O=C(Nc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H22N8O2/c30-21(23-15-10-5-2-6-11-15)27-20-26-18(22-14-8-3-1-4-9-14)25-19-24-17(28-29(19)20)16-12-7-13-31-16/h2,5-7,10-14H,1,3-4,8-9H2,(H3,22,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 946 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137529
(CHEMBL3754417)Show SMILES O=C(Cc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H23N7O2/c30-18(14-15-8-3-1-4-9-15)24-21-26-20(23-16-10-5-2-6-11-16)27-22-25-19(28-29(21)22)17-12-7-13-31-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137518
(CHEMBL3752421)Show SMILES O=C(Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H21N7O2/c29-18(14-8-3-1-4-9-14)24-21-26-19(22-15-10-5-2-6-11-15)25-20-23-17(27-28(20)21)16-12-7-13-30-16/h1,3-4,7-9,12-13,15H,2,5-6,10-11H2,(H2,22,23,24,25,26,27,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137523
(CHEMBL3754685)Show SMILES CC(C)Nc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H18N8O2/c1-11(2)19-15-22-16-21-14(13-9-6-10-28-13)25-26(16)17(23-15)24-18(27)20-12-7-4-3-5-8-12/h3-11H,1-2H3,(H3,19,20,21,22,23,24,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137635
(CHEMBL3754124)Show SMILES Fc1ccc(CNc2nc(NC3CCCCC3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H22FN7O/c22-15-10-8-14(9-11-15)13-23-20-26-19(24-16-5-2-1-3-6-16)27-21-25-18(28-29(20)21)17-7-4-12-30-17/h4,7-12,16H,1-3,5-6,13H2,(H2,23,24,25,26,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137517
(CHEMBL3752342)Show SMILES O=C(Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H17N7O2/c30-19(16-10-5-2-6-11-16)25-22-27-20(23-14-15-8-3-1-4-9-15)26-21-24-18(28-29(21)22)17-12-7-13-31-17/h1-13H,14H2,(H2,23,24,25,26,27,28,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137636
(CHEMBL3752432)Show SMILES Fc1ccc(CNc2nc(NCc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C22H18FN7O/c23-17-10-8-16(9-11-17)14-25-21-27-20(24-13-15-5-2-1-3-6-15)28-22-26-19(29-30(21)22)18-7-4-12-31-18/h1-12H,13-14H2,(H2,24,25,26,27,28,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137525
(CHEMBL3752868)Show InChI InChI=1S/C9H9N7O/c1-11-8-13-7(10)16-9(14-8)12-6(15-16)5-3-2-4-17-5/h2-4H,1H3,(H3,10,11,12,13,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137516
(CHEMBL3754704)Show InChI InChI=1S/C17H15N7O2/c1-18-15-21-16(19-13(25)10-11-6-3-2-4-7-11)24-17(22-15)20-14(23-24)12-8-5-9-26-12/h2-9H,10H2,1H3,(H2,18,19,20,21,22,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50137519
(CHEMBL3754760)Show SMILES CC(C)Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H17N7O2/c1-11(2)19-16-22-17-20-14(13-9-6-10-27-13)24-25(17)18(23-16)21-15(26)12-7-4-3-5-8-12/h3-11H,1-2H3,(H2,19,20,21,22,23,24,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137525
(CHEMBL3752868)Show InChI InChI=1S/C9H9N7O/c1-11-8-13-7(10)16-9(14-8)12-6(15-16)5-3-2-4-17-5/h2-4H,1H3,(H3,10,11,12,13,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137631
(CHEMBL3754336)Show InChI InChI=1S/C16H15N7O/c1-17-14-20-15(18-10-11-6-3-2-4-7-11)23-16(21-14)19-13(22-23)12-8-5-9-24-12/h2-9H,10H2,1H3,(H2,17,18,19,20,21,22) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.77E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137634
(CHEMBL3752753)Show InChI InChI=1S/C16H14FN7O/c1-18-14-21-15(19-9-10-4-6-11(17)7-5-10)24-16(22-14)20-13(23-24)12-3-2-8-25-12/h2-8H,9H2,1H3,(H2,18,19,20,21,22,23) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137524
(CHEMBL3754353)Show InChI InChI=1S/C16H14N8O2/c1-17-13-20-14-19-12(11-8-5-9-26-11)23-24(14)15(21-13)22-16(25)18-10-6-3-2-4-7-10/h2-9H,1H3,(H3,17,18,19,20,21,22,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137526
(CHEMBL3754099)Show InChI InChI=1S/C11H13N7O/c1-6(2)13-10-15-9(12)18-11(16-10)14-8(17-18)7-4-3-5-19-7/h3-6H,1-2H3,(H3,12,13,14,15,16,17) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 4.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137515
(CHEMBL3752488)Show SMILES CC(C)Nc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C19H19N7O2/c1-12(2)20-17-23-18(21-15(27)11-13-7-4-3-5-8-13)26-19(24-17)22-16(25-26)14-9-6-10-28-14/h3-10,12H,11H2,1-2H3,(H2,20,21,22,23,24,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137518
(CHEMBL3752421)Show SMILES O=C(Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H21N7O2/c29-18(14-8-3-1-4-9-14)24-21-26-19(22-15-10-5-2-6-11-15)25-20-23-17(27-28(20)21)16-12-7-13-30-16/h1,3-4,7-9,12-13,15H,2,5-6,10-11H2,(H2,22,23,24,25,26,27,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137518
(CHEMBL3752421)Show SMILES O=C(Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H21N7O2/c29-18(14-8-3-1-4-9-14)24-21-26-19(22-15-10-5-2-6-11-15)25-20-23-17(27-28(20)21)16-12-7-13-30-16/h1,3-4,7-9,12-13,15H,2,5-6,10-11H2,(H2,22,23,24,25,26,27,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137516
(CHEMBL3754704)Show InChI InChI=1S/C17H15N7O2/c1-18-15-21-16(19-13(25)10-11-6-3-2-4-7-11)24-17(22-15)20-14(23-24)12-8-5-9-26-12/h2-9H,10H2,1H3,(H2,18,19,20,21,22,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137520
(CHEMBL3753604)Show InChI InChI=1S/C16H13N7O2/c1-17-14-20-15-18-12(11-8-5-9-25-11)22-23(15)16(21-14)19-13(24)10-6-3-2-4-7-10/h2-9H,1H3,(H2,17,18,19,20,21,22,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 9.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137520
(CHEMBL3753604)Show InChI InChI=1S/C16H13N7O2/c1-17-14-20-15-18-12(11-8-5-9-25-11)22-23(15)16(21-14)19-13(24)10-6-3-2-4-7-10/h2-9H,1H3,(H2,17,18,19,20,21,22,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137519
(CHEMBL3754760)Show SMILES CC(C)Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H17N7O2/c1-11(2)19-16-22-17-20-14(13-9-6-10-27-13)24-25(17)18(23-16)21-15(26)12-7-4-3-5-8-12/h3-11H,1-2H3,(H2,19,20,21,22,23,24,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.34E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137519
(CHEMBL3754760)Show SMILES CC(C)Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H17N7O2/c1-11(2)19-16-22-17-20-14(13-9-6-10-27-13)24-25(17)18(23-16)21-15(26)12-7-4-3-5-8-12/h3-11H,1-2H3,(H2,19,20,21,22,23,24,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137533
(CHEMBL3753103)Show SMILES Fc1ccc(CNc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H15FN6O2/c22-15-10-8-14(9-11-15)13-23-19-25-21(30-16-5-2-1-3-6-16)26-20-24-18(27-28(19)20)17-7-4-12-29-17/h1-12H,13H2,(H,23,24,25,26,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137532
(CHEMBL3752965)Show SMILES C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H16N6O2/c1-3-8-15(9-4-1)14-22-19-24-21(29-16-10-5-2-6-11-16)25-20-23-18(26-27(19)20)17-12-7-13-28-17/h1-13H,14H2,(H,22,23,24,25,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50137533
(CHEMBL3753103)Show SMILES Fc1ccc(CNc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H15FN6O2/c22-15-10-8-14(9-11-15)13-23-19-25-21(30-16-5-2-1-3-6-16)26-20-24-18(27-28(19)20)17-7-4-12-29-17/h1-12H,13H2,(H,23,24,25,26,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137632
(CHEMBL3754718)Show InChI InChI=1S/C18H19N7O/c1-12(2)20-16-22-17(19-11-13-7-4-3-5-8-13)25-18(23-16)21-15(24-25)14-9-6-10-26-14/h3-10,12H,11H2,1-2H3,(H2,19,20,21,22,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137637
(CHEMBL3754080)Show SMILES Fc1ccc(CNc2nc(NCc3ccc(F)cc3)n3nc(nc3n2)-c2ccco2)cc1 Show InChI InChI=1S/C22H17F2N7O/c23-16-7-3-14(4-8-16)12-25-20-28-21(26-13-15-5-9-17(24)10-6-15)31-22(29-20)27-19(30-31)18-2-1-11-32-18/h1-11H,12-13H2,(H2,25,26,27,28,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50137635
(CHEMBL3754124)Show SMILES Fc1ccc(CNc2nc(NC3CCCCC3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H22FN7O/c22-15-10-8-14(9-11-15)13-23-20-26-19(24-16-5-2-1-3-6-16)27-21-25-18(28-29(20)21)17-7-4-12-30-17/h4,7-12,16H,1-3,5-6,13H2,(H2,23,24,25,26,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranes |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137528
(CHEMBL3752514)Show InChI InChI=1S/C15H13N7O/c16-13-19-14(17-9-10-5-2-1-3-6-10)20-15-18-12(21-22(13)15)11-7-4-8-23-11/h1-8H,9H2,(H3,16,17,18,19,20,21) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137521
(CHEMBL3752621)Show SMILES O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H18N8O2/c31-22(24-16-10-5-2-6-11-16)28-21-27-19(23-14-15-8-3-1-4-9-15)26-20-25-18(29-30(20)21)17-12-7-13-32-17/h1-13H,14H2,(H3,23,24,25,26,27,28,29,31) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137530
(CHEMBL3753079)Show SMILES O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C23H19N7O2/c31-19(14-16-8-3-1-4-9-16)25-22-27-21(24-15-17-10-5-2-6-11-17)28-23-26-20(29-30(22)23)18-12-7-13-32-18/h1-13H,14-15H2,(H2,24,25,26,27,28,29,31) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137633
(CHEMBL3754573)Show SMILES C(Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H19N7O/c1-3-8-16(9-4-1)14-23-20-26-21(24-15-17-10-5-2-6-11-17)29-22(27-20)25-19(28-29)18-12-7-13-30-18/h1-13H,14-15H2,(H2,23,24,25,26,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.18E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137527
(CHEMBL3752431)Show InChI InChI=1S/C14H17N7O/c15-12-18-13(16-9-5-2-1-3-6-9)19-14-17-11(20-21(12)14)10-7-4-8-22-10/h4,7-9H,1-3,5-6H2,(H3,15,16,17,18,19,20) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.34E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137533
(CHEMBL3753103)Show SMILES Fc1ccc(CNc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H15FN6O2/c22-15-10-8-14(9-11-15)13-23-19-25-21(30-16-5-2-1-3-6-16)26-20-24-18(27-28(19)20)17-7-4-12-29-17/h1-12H,13H2,(H,23,24,25,26,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137631
(CHEMBL3754336)Show InChI InChI=1S/C16H15N7O/c1-17-14-20-15(18-10-11-6-3-2-4-7-11)23-16(21-14)19-13(22-23)12-8-5-9-24-12/h2-9H,10H2,1H3,(H2,17,18,19,20,21,22) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137520
(CHEMBL3753604)Show InChI InChI=1S/C16H13N7O2/c1-17-14-20-15-18-12(11-8-5-9-25-11)22-23(15)16(21-14)19-13(24)10-6-3-2-4-7-10/h2-9H,1H3,(H2,17,18,19,20,21,22,24) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137630
(CHEMBL3753690)Show SMILES C(Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H23N7O/c1-3-8-15(9-4-1)14-22-19-25-20(23-16-10-5-2-6-11-16)28-21(26-19)24-18(27-28)17-12-7-13-29-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,22,23,24,25,26,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137636
(CHEMBL3752432)Show SMILES Fc1ccc(CNc2nc(NCc3ccccc3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C22H18FN7O/c23-17-10-8-16(9-11-17)14-25-21-27-20(24-13-15-5-2-1-3-6-15)28-22-26-19(29-30(21)22)18-7-4-12-31-18/h1-12H,13-14H2,(H2,24,25,26,27,28,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137637
(CHEMBL3754080)Show SMILES Fc1ccc(CNc2nc(NCc3ccc(F)cc3)n3nc(nc3n2)-c2ccco2)cc1 Show InChI InChI=1S/C22H17F2N7O/c23-16-7-3-14(4-8-16)12-25-20-28-21(26-13-15-5-9-17(24)10-6-15)31-22(29-20)27-19(30-31)18-2-1-11-32-18/h1-11H,12-13H2,(H2,25,26,27,28,29,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137526
(CHEMBL3754099)Show InChI InChI=1S/C11H13N7O/c1-6(2)13-10-15-9(12)18-11(16-10)14-8(17-18)7-4-3-5-19-7/h3-6H,1-2H3,(H3,12,13,14,15,16,17) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137524
(CHEMBL3754353)Show InChI InChI=1S/C16H14N8O2/c1-17-13-20-14-19-12(11-8-5-9-26-11)23-24(14)15(21-13)22-16(25)18-10-6-3-2-4-7-10/h2-9H,1H3,(H3,17,18,19,20,21,22,23,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137525
(CHEMBL3752868)Show InChI InChI=1S/C9H9N7O/c1-11-8-13-7(10)16-9(14-8)12-6(15-16)5-3-2-4-17-5/h2-4H,1H3,(H3,10,11,12,13,14,15) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137522
(CHEMBL3753012)Show SMILES O=C(Nc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H22N8O2/c30-21(23-15-10-5-2-6-11-15)27-20-26-18(22-14-8-3-1-4-9-14)25-19-24-17(28-29(19)20)16-12-7-13-31-16/h2,5-7,10-14H,1,3-4,8-9H2,(H3,22,23,24,25,26,27,28,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137529
(CHEMBL3754417)Show SMILES O=C(Cc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C22H23N7O2/c30-18(14-15-8-3-1-4-9-15)24-21-26-20(23-16-10-5-2-6-11-16)27-22-25-19(28-29(21)22)17-12-7-13-31-17/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H2,23,24,25,26,27,28,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137523
(CHEMBL3754685)Show SMILES CC(C)Nc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H18N8O2/c1-11(2)19-15-22-16-21-14(13-9-6-10-28-13)25-26(16)17(23-15)24-18(27)20-12-7-4-3-5-8-12/h3-11H,1-2H3,(H3,19,20,21,22,23,24,25,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137519
(CHEMBL3754760)Show SMILES CC(C)Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C18H17N7O2/c1-11(2)19-16-22-17-20-14(13-9-6-10-27-13)24-25(17)18(23-16)21-15(26)12-7-4-3-5-8-12/h3-11H,1-2H3,(H2,19,20,21,22,23,24,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137531
(CHEMBL3753118)Show SMILES C1CCC(CC1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C20H20N6O2/c1-3-8-14(9-4-1)21-18-23-20(28-15-10-5-2-6-11-15)24-19-22-17(25-26(18)19)16-12-7-13-27-16/h2,5-7,10-14H,1,3-4,8-9H2,(H,21,22,23,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137535
(CHEMBL3753698)Show InChI InChI=1S/C17H23N7O/c1-11(2)18-15-21-16(19-12-7-4-3-5-8-12)24-17(22-15)20-14(23-24)13-9-6-10-25-13/h6,9-12H,3-5,7-8H2,1-2H3,(H2,18,19,20,21,22,23) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137635
(CHEMBL3754124)Show SMILES Fc1ccc(CNc2nc(NC3CCCCC3)nc3nc(nn23)-c2ccco2)cc1 Show InChI InChI=1S/C21H22FN7O/c22-15-10-8-14(9-11-15)13-23-20-26-19(24-16-5-2-1-3-6-16)27-21-25-18(28-29(20)21)17-7-4-12-30-17/h4,7-12,16H,1-3,5-6,13H2,(H2,23,24,25,26,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137632
(CHEMBL3754718)Show InChI InChI=1S/C18H19N7O/c1-12(2)20-16-22-17(19-11-13-7-4-3-5-8-13)25-18(23-16)21-15(24-25)14-9-6-10-26-14/h3-10,12H,11H2,1-2H3,(H2,19,20,21,22,23,24) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137634
(CHEMBL3752753)Show InChI InChI=1S/C16H14FN7O/c1-18-14-21-15(19-9-10-4-6-11(17)7-5-10)24-16(22-14)20-13(23-24)12-3-2-8-25-12/h2-8H,9H2,1H3,(H2,18,19,20,21,22,23) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137515
(CHEMBL3752488)Show SMILES CC(C)Nc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C19H19N7O2/c1-12(2)20-17-23-18(21-15(27)11-13-7-4-3-5-8-13)26-19(24-17)22-16(25-26)14-9-6-10-28-14/h3-10,12H,11H2,1-2H3,(H2,20,21,22,23,24,25,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137536
(CHEMBL3753384)Show SMILES C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C20H27N7O/c1-3-8-14(9-4-1)21-18-24-19(22-15-10-5-2-6-11-15)27-20(25-18)23-17(26-27)16-12-7-13-28-16/h7,12-15H,1-6,8-11H2,(H2,21,22,23,24,25,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137532
(CHEMBL3752965)Show SMILES C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H16N6O2/c1-3-8-15(9-4-1)14-22-19-24-21(29-16-10-5-2-6-11-16)25-20-23-18(26-27(19)20)17-12-7-13-28-17/h1-13H,14H2,(H,22,23,24,25,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137516
(CHEMBL3754704)Show InChI InChI=1S/C17H15N7O2/c1-18-15-21-16(19-13(25)10-11-6-3-2-4-7-11)24-17(22-15)20-14(23-24)12-8-5-9-26-12/h2-9H,10H2,1H3,(H2,18,19,20,21,22,23,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137534
(CHEMBL3754333)Show InChI InChI=1S/C15H19N7O/c1-16-13-19-14(17-10-6-3-2-4-7-10)22-15(20-13)18-12(21-22)11-8-5-9-23-11/h5,8-10H,2-4,6-7H2,1H3,(H2,16,17,18,19,20,21) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137518
(CHEMBL3752421)Show SMILES O=C(Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C21H21N7O2/c29-18(14-8-3-1-4-9-14)24-21-26-19(22-15-10-5-2-6-11-15)25-20-23-17(27-28(20)21)16-12-7-13-30-16/h1,3-4,7-9,12-13,15H,2,5-6,10-11H2,(H2,22,23,24,25,26,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50137517
(CHEMBL3752342)Show SMILES O=C(Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1 Show InChI InChI=1S/C22H17N7O2/c30-19(16-10-5-2-6-11-16)25-22-27-20(23-14-15-8-3-1-4-9-15)26-21-24-18(28-29(21)22)17-12-7-13-31-17/h1-13H,14H2,(H2,23,24,25,26,27,28,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Trieste
Curated by ChEMBL
| Assay Description
Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi... |
Eur J Med Chem 108: 529-41 (2016)
Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM |
More data for this
Ligand-Target Pair | |
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