BDBM50137632 CHEMBL3754718

SMILES CC(C)Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1

InChI Key InChIKey=JAHXLVSZGUHXNI-UHFFFAOYSA-N

Data  3 KI  1 IC50

  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 4 hits for monomerid = 50137632   

TargetAdenosine receptor A3(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50137632(CHEMBL3754718)
Affinity DataKi:  114nMAssay Description:Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2017
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50137632(CHEMBL3754718)
Affinity DataKi:  394nMAssay Description:Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2017
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50137632(CHEMBL3754718)
Affinity DataIC50: 3.00E+4nMAssay Description:Antagonist activity at human A2B adenosine receptor expressed in CHO cell membranes assessed as inhibition of NECA stimulated adenylyl cyclase activi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2017
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50137632(CHEMBL3754718)
Affinity DataKi: >1.00E+5nMAssay Description:Displacement of [3H]CCPA from human A1 adenosine receptor expressed in CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2017
Entry Details Article
PubMed