BDBM82558 CAS_163889::CHEMBL355370::I-ABOPX::NSC_163889

SMILES CCCn1c(=O)n(Cc2ccc(N)c(I)c2)c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1

InChI Key InChIKey=DKJMGIXWGPEEFF-UHFFFAOYSA-N

Data  10 KI  2 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 82558   

TargetAdenosine receptor A3(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  15nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  18.2nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  30nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  37nMAssay Description:Displacement of [3H]-PIA from adenosine A1 receptors of rat brain membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  40nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  70nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
University Of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  95nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  700nMAssay Description:Displacement of [3H]-CGS- 21680 from adenosine A2a receptors of rat striatal membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a/A2b(Homo sapiens (Human))
University Of Virginia School Of Medicine

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  700nMAssay Description:Binding affinity to adenosine A1 receptor of rat brain membranes without NaCl by inhibition of [125-I]-labeled aminobenzyl adenosine bindingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Rattus norvegicus)
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKi:  1.17E+3nMAssay Description:Displacement of [125I]-AB-MECA from membranes of CHO cells stably transfected with the rat adenosine A3 receptor cDNAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKd:  0.800nMAssay Description:Binding affinity towards adenosine A1 receptor in rat brain membrane(KD)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(BOVINE)
University Of Virginia School Of Medicine

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataKd:  37nMAssay Description:Displacement of [125-I]-labeled aminobenzyl adenosine binding to adenosine A1 receptor of bovine brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataIC50:  3nMAssay Description:Binding affinity to adenosine A1 receptor of rat brain membranes with 1 M NaCl by inhibition of [125-I]-labeled aminobenzyl adenosine bindingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM82558(CAS_163889 | CHEMBL355370 | I-ABOPX | NSC_163889)
Affinity DataIC50:  3nMAssay Description:Binding affinity to adenosine A1 receptor of rat brain membranes with 1 M NaCl by inhibition of [125-I]-labeled aminobenzyl adenosine bindingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed