Found 2 hits in this display Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Adenosine kinase
(Homo sapiens (Human)) | BDBM50201828
(CHEMBL226503 | [5-(4-chlorophenyl)-6-(4-dimethylam...)Show SMILES CN(C)c1ccc(cc1)C#Cc1ncnc(NCCc2c[nH]c3ccccc23)c1-c1ccc(Cl)cc1 Show InChI InChI=1S/C30H26ClN5/c1-36(2)25-14-7-21(8-15-25)9-16-28-29(22-10-12-24(31)13-11-22)30(35-20-34-28)32-18-17-23-19-33-27-6-4-3-5-26(23)27/h3-8,10-15,19-20,33H,17-18H2,1-2H3,(H,32,34,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of cytosolic adenosine kinase |
Bioorg Med Chem 15: 1586-605 (2007)
Article DOI: 10.1016/j.bmc.2006.12.029
BindingDB Entry DOI: 10.7270/Q2G44PZP |
More data for this
Ligand-Target Pair | |
Adenosine kinase
(Homo sapiens (Human)) | BDBM50201828
(CHEMBL226503 | [5-(4-chlorophenyl)-6-(4-dimethylam...)Show SMILES CN(C)c1ccc(cc1)C#Cc1ncnc(NCCc2c[nH]c3ccccc23)c1-c1ccc(Cl)cc1 Show InChI InChI=1S/C30H26ClN5/c1-36(2)25-14-7-21(8-15-25)9-16-28-29(22-10-12-24(31)13-11-22)30(35-20-34-28)32-18-17-23-19-33-27-6-4-3-5-26(23)27/h3-8,10-15,19-20,33H,17-18H2,1-2H3,(H,32,34,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of adenosine kinase in intact cells assessed as adenosine phosphorylation |
Bioorg Med Chem 15: 1586-605 (2007)
Article DOI: 10.1016/j.bmc.2006.12.029
BindingDB Entry DOI: 10.7270/Q2G44PZP |
More data for this
Ligand-Target Pair | |