Found 4 hits for monomerid = 50199692 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 A2a
(Homo sapiens (Human)) | BDBM50199692
(CHEMBL3955694)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C35H36Cl2N8O5/c1-2-45-34(48)30(41-35(49)42-31-27(36)19-38-20-28(31)37)18-29(43-45)22-5-3-4-21(14-22)23-15-24(17-25(16-23)33(47)40-26-6-7-26)32(46)39-8-9-44-10-12-50-13-11-44/h3-5,14-20,26H,2,6-13H2,1H3,(H,39,46)(H,40,47)(H2,38,41,42,49) | 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
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description Antagonist activity at adenosine A2a receptor (unknown origin) |
J Med Chem 59: 10479-10497 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00829 BindingDB Entry DOI: 10.7270/Q21G0P75 |
More data for this Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50199692
(CHEMBL3955694)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C35H36Cl2N8O5/c1-2-45-34(48)30(41-35(49)42-31-27(36)19-38-20-28(31)37)18-29(43-45)22-5-3-4-21(14-22)23-15-24(17-25(16-23)33(47)40-26-6-7-26)32(46)39-8-9-44-10-12-50-13-11-44/h3-5,14-20,26H,2,6-13H2,1H3,(H,39,46)(H,40,47)(H2,38,41,42,49) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description Antagonist activity at adenosine A1 receptor (unknown origin) |
J Med Chem 59: 10479-10497 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00829 BindingDB Entry DOI: 10.7270/Q21G0P75 |
More data for this Ligand-Target Pair | |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50199692
(CHEMBL3955694)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C35H36Cl2N8O5/c1-2-45-34(48)30(41-35(49)42-31-27(36)19-38-20-28(31)37)18-29(43-45)22-5-3-4-21(14-22)23-15-24(17-25(16-23)33(47)40-26-6-7-26)32(46)39-8-9-44-10-12-50-13-11-44/h3-5,14-20,26H,2,6-13H2,1H3,(H,39,46)(H,40,47)(H2,38,41,42,49) | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description Antagonist activity at adenosine A2b receptor (unknown origin) |
J Med Chem 59: 10479-10497 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00829 BindingDB Entry DOI: 10.7270/Q21G0P75 |
More data for this Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50199692
(CHEMBL3955694)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C35H36Cl2N8O5/c1-2-45-34(48)30(41-35(49)42-31-27(36)19-38-20-28(31)37)18-29(43-45)22-5-3-4-21(14-22)23-15-24(17-25(16-23)33(47)40-26-6-7-26)32(46)39-8-9-44-10-12-50-13-11-44/h3-5,14-20,26H,2,6-13H2,1H3,(H,39,46)(H,40,47)(H2,38,41,42,49) | PDB
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.0900 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description Inhibition of human recombinant PDE4B1 assessed as reduction in [3H]cAMP hydrolysis to [3H]AMP incubated for 60 mins by PDE-SPA assay |
J Med Chem 59: 10479-10497 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00829 BindingDB Entry DOI: 10.7270/Q21G0P75 |
More data for this Ligand-Target Pair | |