Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50053929
Substrate
n/a
Meas. Tech.
ChEMBL_2151812 (CHEMBL5036274)
Ki
1700±n/a nM
Citation
 Miranda-Pastoriza, D; Bernárdez, R; Azuaje, J; Prieto-Díaz, R; Majellaro, M; Tamhankar, AV; Koenekoop, L; González, A; Gioé-Gallo, C; Mallo-Abreu, A; Brea, J; Loza, MI; García-Rey, A; García-Mera, X; Gutiérrez-de-Terán, H; Sotelo, E Exploring Non-orthosteric Interactions with a Series of Potent and Selective A ACS Med Chem Lett 13:243-249 (2022) [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:
BDBM50053929
Synonyms:
CHEMBL88147 | N-(9-Chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenyl-acetamide | N-(9-Chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-N-methyl-2-phenyl-acetamide | N-(9-chloro-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenylacetamide
Type:
Small organic molecule
Emp. Form.:
C21H14ClN5O2
Mol. Mass.:
403.821
SMILES:
Clc1ccc2nc(NC(=O)Cc3ccccc3)n3nc(nc3c2c1)-c1ccco1
Structure:
Search PDB for entries with ligand similarity: