Found 5 hits for monomerid = 50292320 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50292320
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4| Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Monash University (Parkville Campus)
Curated by ChEMBL
| Assay Description Binding affinity to adenosine A1 receptor |
Bioorg Med Chem Lett 17: 5437-41 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.035 BindingDB Entry DOI: 10.7270/Q2VX0G7M |
More data for this Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50292320
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4| Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to adenosine A3 receptor |
Bioorg Med Chem 18: 3078-87 (2010)
Article DOI: 10.1016/j.bmc.2010.03.047 BindingDB Entry DOI: 10.7270/Q2X63N4V |
More data for this Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50292320
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4| Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Monash University (Parkville Campus)
Curated by ChEMBL
| Assay Description Binding affinity to adenosine A3 receptor |
Bioorg Med Chem Lett 17: 5437-41 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.035 BindingDB Entry DOI: 10.7270/Q2VX0G7M |
More data for this Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50292320
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4| Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1 | NCI pathway 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 |
Monash University (Parkville Campus)
Curated by ChEMBL
| Assay Description Binding affinity to adenosine A2B receptor |
Bioorg Med Chem Lett 17: 5437-41 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.035 BindingDB Entry DOI: 10.7270/Q2VX0G7M |
More data for this Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50292320
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4| Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Monash University (Parkville Campus)
Curated by ChEMBL
| Assay Description Binding affinity to adenosine A2A receptor |
Bioorg Med Chem Lett 17: 5437-41 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.035 BindingDB Entry DOI: 10.7270/Q2VX0G7M |
More data for this Ligand-Target Pair | |