BDBM50427598 CHEMBL2322924

SMILES COc1ccc(cc1)C(=O)Nc1nc(C)nc2cn(nc12)-c1ccccc1

InChI Key InChIKey=YIYCMRYEOUXQND-UHFFFAOYSA-N

Data  2 KI  1 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 3 hits for monomerid = 50427598   

TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50427598(CHEMBL2322924)
Affinity DataIC50: 20nMAssay Description:Antagonist activity at human adenosine A3A receptor expressed in CHO cells assessed as inhibition of cAMP accumulationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50427598(CHEMBL2322924)
Affinity DataKi:  2.40nMAssay Description:Displacement of [125I]AB-MECA from human A3 adenosine receptor expressed in CHO cells after 60 mins by scintillation counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50427598(CHEMBL2322924)
Affinity DataKi:  2.40nMAssay Description:Binding affinity to human adenosine A3A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed