BDBM50035800 (S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phenyl)-1,4-dihydro-pyridine-3-carboxylic acid methyl ester::CHEMBL105672::CHEMBL283013

SMILES COC(=[OH+])C1=C(C)[N-]C(C)=C(C1c1ccccc1C(F)(F)F)[N+]([O-])=O

InChI Key InChIKey=JWCBVRAPFWTEMZ-UHFFFAOYSA-N

Data  13 KI  1 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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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50035800   

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

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  785nMAssay Description:Displacement of [3H](R)-PIA binding to Adenosine A1 receptor in rat brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  785nMAssay 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 A3(Homo sapiens (Human))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  2.77E+3nMAssay Description:Displacement of [125]AB-MECA binding to human Adenosine A3 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  2.77E+3nMAssay 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(Rattus norvegicus)
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  6.20E+3nMAssay Description:Binding affinity against rat Adenosine A3 receptor from CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  6.66E+3nMAssay 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(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  6.66E+3nMAssay Description:Displacement of [3H](R)-PIA binding to Adenosine A1 receptor in rat brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  2.35E+4nMAssay Description:Displacement of [125]AB-MECA binding to human Adenosine A3 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  2.35E+4nMAssay 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 A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  3.51E+4nMAssay Description:Displacement of [3H]-CGS- 21680 binding to Adenosine A2A receptor in rat striatal membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  3.51E+4nMAssay Description:Displacement of [3H]-CGS-21,680 from Adenosine A2A receptor of rat striatal membrane at 10e-4 microMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  8.63E+4nMAssay Description:Displacement of [3H]-CGS- 21680 binding to Adenosine A2A receptor in rat striatal membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
National Institute Of Diabetes

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKi:  8.63E+4nMAssay Description:Displacement of [3H]-CGS-21,680 from Adenosine A2A receptor of rat striatal membrane at 10e-4 microMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVoltage-dependent L-type calcium channel subunit alpha-1C(Homo sapiens (Human))
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50035800((S)-2,6-Dimethyl-5-nitro-4-(2-trifluoromethyl-phen...)
Affinity DataKd:  18nMAssay Description:Displacement of [3H]nitrendipine from dihydropyridine receptor of guinea pig myocardial membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed