BDBM50452335 CHEMBL2113484

SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCc3ccccc3)ncnc12

InChI Key InChIKey=UBRRRMDHTZACMR-NVQRDWNXSA-N

Data  7 KI  1 IC50

PDB links: 1 PDB ID matches this monomer.

  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 2 hits for monomerid = 50452335   

TargetAdenosine receptor A2a(Homo sapiens (Human))
Institute Of Medical Biology Pas

Curated by ChEMBL
LigandPNGBDBM50452335(CHEMBL2113484)
Affinity DataKi:  2.05E+3nMAssay Description:Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in HeLa cell membrane incubated for 30 mins by microplate beta scintillation...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Institute Of Medical Biology Pas

Curated by ChEMBL
LigandPNGBDBM50452335(CHEMBL2113484)
Affinity DataIC50:  2.03E+4nMAssay Description:Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in HeLa cells by beta scintillation counting analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed