Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50427579
Substrate
n/a
Meas. Tech.
ChEMBL_941721 (CHEMBL2330944)
Ki
35±n/a nM
Citation
 Squarcialupi, L; Colotta, V; Catarzi, D; Varano, F; Filacchioni, G; Varani, K; Corciulo, C; Vincenzi, F; Borea, PA; Ghelardini, C; Di Cesare Mannelli, L; Ciancetta, A; Moro, S 2-Arylpyrazolo[4,3-d]pyrimidin-7-amino derivatives as new potent and selective human A3 adenosine receptor antagonists. Molecular modeling studies and pharmacological evaluation. J Med Chem 56:2256-69 (2013) [PubMed]  Article 
Target
Name:
Adenosine receptor A3
Synonyms:
A3 adenosine receptor (hA3) | AA3R_HUMAN | ADORA3 | Adenosine A3 receptor (A3AR)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36197.32
Organism:
Homo sapiens (Human)
Description:
P0DMS8
Residue:
318
Sequence:
MPNNSTALSLANVTYITMEIFIGLCAIVGNVLVICVVKLNPSLQTTTFYFIVSLALADIAVGVLVMPLAIVVSLGITIHFYSCLFMTCLLLIFTHASIMSLLAIAVDRYLRVKLTVRYKRVTTHRRIWLALGLCWLVSFLVGLTPMFGWNMKLTSEYHRNVTFLSCQFVSVMRMDYMVYFSFLTWIFIPLVVMCAIYLDIFYIIRNKLSLNLSNSKETGAFYGREFKTAKSLFLVLFLFALSWLPLSIINCIIYFNGEVPQLVLYMGILLSHANSMMNPIVYAYKIKKFKETYLLILKACVVCHPSDSLDTSIEKNSE
  
Inhibitor
Name:
BDBM50427579
Synonyms:
CHEMBL2322903
Type:
Small organic molecule
Emp. Form.:
C20H17N5O2
Mol. Mass.:
359.3813
SMILES:
COc1ccc(cc1)-n1cc2nc(C)nc(NC(=O)c3ccccc3)c2n1
Structure:
Search PDB for entries with ligand similarity: