BDBM50496135 CHEMBL3121720

SMILES CN(C)CCOc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1

InChI Key InChIKey=VDABXKVHAPGDRV-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50496135   

TargetAdenosine receptor A2a(Human)
Panjab University

Curated by ChEMBL
LigandPNGBDBM50496135(CHEMBL3121720)
Affinity DataKi:  0.400nMAssay Description:Displacement of [3H]-NECA from human recombinant adenosine A2A receptor expressed in CHO cell membranes after 3 hrs by microbeta counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Panjab University

Curated by ChEMBL
LigandPNGBDBM50496135(CHEMBL3121720)
Affinity DataKi:  1.80nMAssay Description:Displacement of [3H]-CCPA from human recombinant adenosine A1 receptor expressed in CHO cell membranes after 3 hrs by microbeta counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
Panjab University

Curated by ChEMBL
LigandPNGBDBM50496135(CHEMBL3121720)
Affinity DataKi:  5nMAssay Description:Binding affinity to human recombinant adenosine A2B receptor expressed in CHO cell membranes assessed as inhibition of NECA-stimulated adenylyl cycla...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
Panjab University

Curated by ChEMBL
LigandPNGBDBM50496135(CHEMBL3121720)
Affinity DataKi:  9.40nMAssay Description:Displacement of [3H]-HEMADO from human recombinant adenosine A3 receptor expressed in CHO cell membranes after 3 hrs by microbeta counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed