Found 4 hits for monomerid = 50199729 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)) | BDBM50199729
(CHEMBL3922464)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C36H38Cl2N8O4/c1-2-46-35(49)31(42-36(50)43-32-28(37)20-39-21-29(32)38)19-30(44-46)23-8-6-7-22(15-23)24-16-25(18-26(17-24)34(48)41-27-9-10-27)33(47)40-11-14-45-12-4-3-5-13-45/h6-8,15-21,27H,2-5,9-14H2,1H3,(H,40,47)(H,41,48)(H2,39,42,43,50) | 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)) | BDBM50199729
(CHEMBL3922464)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C36H38Cl2N8O4/c1-2-46-35(49)31(42-36(50)43-32-28(37)20-39-21-29(32)38)19-30(44-46)23-8-6-7-22(15-23)24-16-25(18-26(17-24)34(48)41-27-9-10-27)33(47)40-11-14-45-12-4-3-5-13-45/h6-8,15-21,27H,2-5,9-14H2,1H3,(H,40,47)(H,41,48)(H2,39,42,43,50) | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 95 | 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 | |
Adenosine receptor A2a
(Homo sapiens (Human)) | BDBM50199729
(CHEMBL3922464)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C36H38Cl2N8O4/c1-2-46-35(49)31(42-36(50)43-32-28(37)20-39-21-29(32)38)19-30(44-46)23-8-6-7-22(15-23)24-16-25(18-26(17-24)34(48)41-27-9-10-27)33(47)40-11-14-45-12-4-3-5-13-45/h6-8,15-21,27H,2-5,9-14H2,1H3,(H,40,47)(H,41,48)(H2,39,42,43,50) | 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 | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50199729
(CHEMBL3922464)Show SMILES CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C36H38Cl2N8O4/c1-2-46-35(49)31(42-36(50)43-32-28(37)20-39-21-29(32)38)19-30(44-46)23-8-6-7-22(15-23)24-16-25(18-26(17-24)34(48)41-27-9-10-27)33(47)40-11-14-45-12-4-3-5-13-45/h6-8,15-21,27H,2-5,9-14H2,1H3,(H,40,47)(H,41,48)(H2,39,42,43,50) | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.0600 | 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 | |
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