Found 4 hits for monomerid = 50292323 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)) | BDBM50292323
(CHEMBL400567 | N6-(1,1,3,3-tetramethylisoindolin-2...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12 |^1:4| Show InChI InChI=1S/C22H27N6O5/c1-21(2)12-6-5-11(7-13(12)22(3,4)28(21)32)26-18-15-19(24-9-23-18)27(10-25-15)20-17(31)16(30)14(8-29)33-20/h5-7,9-10,14,16-17,20,29-31H,8H2,1-4H3,(H,23,24,26)/t14-,16-,17-,20-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 |
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)) | BDBM50292323
(CHEMBL400567 | N6-(1,1,3,3-tetramethylisoindolin-2...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12 |^1:4| Show InChI InChI=1S/C22H27N6O5/c1-21(2)12-6-5-11(7-13(12)22(3,4)28(21)32)26-18-15-19(24-9-23-18)27(10-25-15)20-17(31)16(30)14(8-29)33-20/h5-7,9-10,14,16-17,20,29-31H,8H2,1-4H3,(H,23,24,26)/t14-,16-,17-,20-/m1/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 790 | 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)) | BDBM50292323
(CHEMBL400567 | N6-(1,1,3,3-tetramethylisoindolin-2...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12 |^1:4| Show InChI InChI=1S/C22H27N6O5/c1-21(2)12-6-5-11(7-13(12)22(3,4)28(21)32)26-18-15-19(24-9-23-18)27(10-25-15)20-17(31)16(30)14(8-29)33-20/h5-7,9-10,14,16-17,20,29-31H,8H2,1-4H3,(H,23,24,26)/t14-,16-,17-,20-/m1/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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 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)) | BDBM50292323
(CHEMBL400567 | N6-(1,1,3,3-tetramethylisoindolin-2...)Show SMILES CC1(C)N([O])C(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12 |^1:4| Show InChI InChI=1S/C22H27N6O5/c1-21(2)12-6-5-11(7-13(12)22(3,4)28(21)32)26-18-15-19(24-9-23-18)27(10-25-15)20-17(31)16(30)14(8-29)33-20/h5-7,9-10,14,16-17,20,29-31H,8H2,1-4H3,(H,23,24,26)/t14-,16-,17-,20-/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 | |