BDBM50399588 CHEMBL2181152

SMILES CC[C@@H](C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1

InChI Key InChIKey=LVFMVYMRLFXZPP-UHFFFAOYSA-N

Data  8 KI

  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 8 hits for monomerid = 50399588   

TargetAdenosine receptor A3(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  5.23nMAssay Description:Displacement of [3H]NECA from human adenosine A3 receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  5.93nMAssay Description:Displacement of [3H]NECA from human adenosine A3 receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  131nMAssay Description:Displacement of [3H]CCPA from human adenosine A1 receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  165nMAssay Description:Displacement of [3H]CCPA from human adenosine A1 receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  248nMAssay Description:Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  272nMAssay Description:Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  3.86E+3nMAssay Description:Antagonist activity at human adenosine A2B receptor expressed in CHO cells assessed as NECA-induced adenylate cyclase activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Trieste

Curated by ChEMBL
LigandPNGBDBM50399588(CHEMBL2181152)
Affinity DataKi:  4.81E+3nMAssay Description:Antagonist activity at human adenosine A2B receptor expressed in CHO cells assessed as NECA-induced adenylate cyclase activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed