Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM333221
Substrate
n/a
Meas. Tech.
Assay for Binding Affinity for Adenosine Receptor A3
Ki
55±n/a nM
Citation
 Lee, J; Kim, S; Kim, D; Ahn, K; Lee, G; Kim, D; Hwang, H Compounds antagonizing A3 adenosine receptor, method for preparing them, and medical-use thereof US Patent  US10196396 Publication Date 2/5/2019 
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:
BDBM333221
Synonyms:
3-(((3-((2S,3R,4S)-3,4-dihydroxytetrahydrothiophen-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino)methyl)benzonitrile | US10196396, Compound 16
Type:
Small organic molecule
Emp. Form.:
C17H16N6O2S
Mol. Mass.:
368.413
SMILES:
O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3cccc(c3)C#N)nccn12
Structure:
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