BDBM50048454 3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]thiophene-1-carboxylic acid ethyl ester::CHEMBL87496

SMILES CCOC(=O)c1sc(SCc2ccccc2)c2c1CCCC2=O

InChI Key InChIKey=HHGLCIVVJISXCA-UHFFFAOYSA-N

Data  9 KI

  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 9 hits for monomerid = 50048454   

TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  720nMAssay Description:Tested for the displacement [3H]-PIA from Adenosine A1 receptor in rat brain membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  720nMAssay Description:Tested for the displacement [3H]-PIA from Adenosine A1 receptor in rat brain membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  720nMAssay Description:Displacement of specific [3H]-PIA binding from adenosine A1 receptor in rat brain membranes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  1.36E+3nMAssay Description:Displacement [3H]-CGS-21,680 from Adenosine A2A receptor in rat striatal membrane.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  1.36E+3nMAssay Description:Affinity at Adenosine A2A receptor in rat striatal membranes by [3H]- CGS 21680 displacement.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  1.36E+3nMAssay Description:Displacement [3H]-CGS-21,680 from Adenosine A2A receptor in rat striatal membrane.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Niddk

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  5.43E+4nMAssay Description:Binding affinity for HA-tagged mutant human Adenosine A2A receptor (H250N) using [3H]-CGS-21,680 as radioligand expressed in COS-7 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Niddk

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  7.26E+4nMAssay Description:Binding affinity for HA-tagged mutant human Adenosine A2A receptor (V84L), using [3H]CGS-21680 as radioligand expressed in COS-7 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Niddk

Curated by ChEMBL
LigandPNGBDBM50048454(3-Benzylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]...)
Affinity DataKi:  1.06E+5nMAssay Description:Binding affinity for HA-tagged wild type human Adenosine A2A receptor (WT) using [3H]CGS-21680 as radioligand expressed in COS-7 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed