BDBM85776 CAS_393594::CHEMBL89852::MRS1191::NSC_393594

SMILES CCOC(=O)C1C(C#Cc2ccccc2)C(C(=O)OCc2ccccc2)=C(N=C1C)c1ccccc1

InChI Key InChIKey=GQCIGLRUTYVQRP-UHFFFAOYSA-N

Data  12 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 85776   

TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  0.0310nMAssay Description:Binding affinity at cloned human adenosine A3 receptor expressed in HEK-293 cells was determined using [125I]-AB-MECA as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  22.2nMAssay Description:Displacement of [125 I]AB-MECA from Adenosine A3 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  31nMAssay Description:Displacement of specific [125I]-AB-MECA binding at human adenosine A3 receptor.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  31nMAssay Description:Inhibition of [125I]- AB-MECA binding to human Adenosine A3 receptors expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A1(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  40.1nMAssay Description:Binding affinity was determined in radioligand binding assay at rat brain adenosine A1 receptor vs [3H]-R-PIAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A2a(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi: >100nMAssay Description:Binding affinity was determined in radioligand binding assay at rat striatal Adenosine A2A receptor vs [3H]-CGS- 21680More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  1.42E+3nMAssay Description:Displacement of specific [125I]-AB-MECA binding at rat Adenosine A3 receptor in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  1.42E+3nMAssay Description:Displacement of specific [125I]-AB-MECA binding at rat Adenosine A3 receptor stably expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A3(Chicken)
University of Illinois At Chicago

Curated by PDSP Ki Database
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  1.70E+3nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A1(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  4.01E+4nMAssay Description:Displacement of specific [3H]-(R)-PIA binding at adenosine A1 receptor from rat brain membranes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A1(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  4.01E+4nMAssay Description:Displacement of [3H]-R-PIA from adenosine A1 receptor of rat brain membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAdenosine receptor A1(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM85776(CAS_393594 | CHEMBL89852 | MRS1191 | NSC_393594)
Affinity DataKi:  4.01E+4nMAssay Description:Binding affinity against adenosine A1 receptor in rat cerebral cortex membrane by radioligand binding assay using [3H](R)-PIA.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed