Found 3 hits for monomerid = 50414356 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 A2b
(Homo sapiens (Human)) | BDBM50414356
(CHEMBL565192)Show SMILES CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NN2CCc3ccccc3C2)cc1 Show InChI InChI=1S/C28H32N6O5/c1-3-33-27(36)24-26(34(28(33)37)14-6-16-38-2)30-25(29-24)20-9-11-22(12-10-20)39-18-23(35)31-32-15-13-19-7-4-5-8-21(19)17-32/h4-5,7-12H,3,6,13-18H2,1-2H3,(H,29,30)(H,31,35) | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 49.0 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de A Coru£a
Curated by ChEMBL
| Assay Description Binding affinity to human adenosine A2b receptor expressed in HEK293 cells |
Bioorg Med Chem 17: 3426-32 (2009)
Article DOI: 10.1016/j.bmc.2009.03.029 BindingDB Entry DOI: 10.7270/Q2XD12XF |
More data for this Ligand-Target Pair | |
Adenosine receptor A1
(Rattus norvegicus (rat)) | BDBM50414356
(CHEMBL565192)Show SMILES CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NN2CCc3ccccc3C2)cc1 Show InChI InChI=1S/C28H32N6O5/c1-3-33-27(36)24-26(34(28(33)37)14-6-16-38-2)30-25(29-24)20-9-11-22(12-10-20)39-18-23(35)31-32-15-13-19-7-4-5-8-21(19)17-32/h4-5,7-12H,3,6,13-18H2,1-2H3,(H,29,30)(H,31,35) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de A Coru£a
Curated by ChEMBL
| Assay Description Binding affinity to rat cortex adenosine A1 receptor |
Bioorg Med Chem 17: 3426-32 (2009)
Article DOI: 10.1016/j.bmc.2009.03.029 BindingDB Entry DOI: 10.7270/Q2XD12XF |
More data for this Ligand-Target Pair | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50414356
(CHEMBL565192)Show SMILES CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NN2CCc3ccccc3C2)cc1 Show InChI InChI=1S/C28H32N6O5/c1-3-33-27(36)24-26(34(28(33)37)14-6-16-38-2)30-25(29-24)20-9-11-22(12-10-20)39-18-23(35)31-32-15-13-19-7-4-5-8-21(19)17-32/h4-5,7-12H,3,6,13-18H2,1-2H3,(H,29,30)(H,31,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 229 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de A Coru£a
Curated by ChEMBL
| Assay Description Binding affinity to human adenosine A2a receptor expressed in human HeLa cells |
Bioorg Med Chem 17: 3426-32 (2009)
Article DOI: 10.1016/j.bmc.2009.03.029 BindingDB Entry DOI: 10.7270/Q2XD12XF |
More data for this Ligand-Target Pair | |