BDBM50494582 CHEMBL3093311

SMILES COc1ccccc1CN1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21

InChI Key InChIKey=JPSHMMIAEATEIY-UHFFFAOYSA-N

Data  6 KI  2 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50494582   

TargetAdenosine receptor A2a(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi:  417nMAssay Description:Displacement of [3H]MSX-2 from human adenosine A2A receptor expressed in CHO cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi:  605nMAssay Description:Displacement of [3H]CCPA from human adenosine A1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi:  641nMAssay Description:Displacement of [3H]MSX-2 from adenosine A2A receptor in rat brain striatumMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi: >1.00E+3nMAssay Description:Displacement of [3H]PSB-603 from human adenosine A2B receptorMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi:  1.06E+3nMAssay Description:Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortexMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataKi:  4.41E+3nMAssay Description:Displacement of [3H]PSB-11 from human adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataIC50:  1.80E+3nMAssay Description:Inhibition of human MAO-BMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50494582(CHEMBL3093311)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of human MAO-AMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed