BDBM50020988 8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione::8-(4-Chlorophenyl)theophylline::CHEMBL269218

SMILES Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(Cl)cc1

InChI Key InChIKey=PJMZAQWLPMVOMG-UHFFFAOYSA-N

Data  3 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50020988   

TargetAdenosine receptor A1(Rattus norvegicus (rat))
Center For Bio-Pharmaceutical Sciences

Curated by ChEMBL
LigandPNGBDBM50020988(8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purin...)
Affinity DataKi:  0.650nMAssay Description:Evaluated for binding affinity against Adenosine A1 receptorChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
Center For Bio-Pharmaceutical Sciences

Curated by ChEMBL
LigandPNGBDBM50020988(8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purin...)
Affinity DataKi:  47.7nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Warner-Lambert/Parke-Davis Pharmaceutical Research

Curated by PDSP Ki Database
LigandPNGBDBM50020988(8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purin...)
Affinity DataKi:  371nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A1(BOVINE)
TBA

Curated by ChEMBL
LigandPNGBDBM50020988(8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purin...)
Affinity DataIC50:  0.800nMAssay Description:Binding affinity against bovine brain adenosine A1 receptor by using N6-[3H]- cyclohexyladenosineChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
Center For Bio-Pharmaceutical Sciences

Curated by ChEMBL
LigandPNGBDBM50020988(8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purin...)
Affinity DataIC50:  0.800nMAssay Description:Binding affinity against adenosine A1 receptor in rat brain membrane preparations using N6-[3H]-cyclohexyladenosine as a radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed