BDBM50559039 CHEMBL4745748

SMILES Cn1cc2c(n1)nc(NC(=O)CCCc1cn(CCCCCCNC(=O)c3ccc(c(c3)C(O)=O)-c3c4ccc(N)c(c4oc4c(c(=N)ccc34)S(O)(=O)=O)S(O)(=O)=O)nn1)n1nc(nc21)-c1ccco1

InChI Key InChIKey=XEABBZPOOUCNPW-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50559039   

TargetAdenosine receptor A3(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50559039(CHEMBL4745748)
Affinity DataKi:  32nMAssay Description:Displacement of [125I]AB-MEC from recombinant human A3R expressed in CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50559039(CHEMBL4745748)
Affinity DataKi:  90nMAssay Description:Displacement of [3H]CGS21680 from recombinant human A2AAR expressed in HEK293 cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed