Compile Data Set for Download or QSAR

Found 40 hits of Enzyme Inhibition Constant Data   

TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119678((R)-5-Benzo[1,3]dioxol-5-yl-2-isopropylamino-7-(4-...)copy SMILEScopy InChI
Affinity DataIC50: 0.100nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119676((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 0.120nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119665(5-Benzo[1,3]dioxol-5-yl-2-but-3-enyl-7-(4-methoxy-...)copy SMILEScopy InChI
Affinity DataIC50: 0.200nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119671(5-Benzo[1,3]dioxol-5-yl-2-butyl-7-(4-methoxy-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 0.210nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119663(5-Benzo[1,3]dioxol-5-yl-2-isobutyl-7-(4-methoxy-ph...)copy SMILEScopy InChI
Affinity DataIC50: 0.320nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119670(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pro...)copy SMILEScopy InChI
Affinity DataIC50: 0.370nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119673((R)-5-Benzo[1,3]dioxol-5-yl-2-ethoxymethyl-7-(4-me...)copy SMILEScopy InChI
Affinity DataIC50: 0.510nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119662((R)-5-Benzo[1,3]dioxol-5-yl-2-(3-hydroxy-propyl)-7...)copy SMILEScopy InChI
Affinity DataIC50: 0.550nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119674((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 0.920nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119664((R)-5-Benzo[1,3]dioxol-5-yl-2-but-3-enyl-7-(4-meth...)copy SMILEScopy InChI
Affinity DataIC50: 1.60nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119661(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pen...)copy SMILEScopy InChI
Affinity DataIC50: 1.90nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119659((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 2.20nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119672((5S,7R)-5-(1,3-benzodioxol-5-yl)-7-(4-methoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 2.40nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119667((R)-5-Benzo[1,3]dioxol-5-yl-2-(isopropyl-methyl-am...)copy SMILEScopy InChI
Affinity DataIC50: 3.20nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119660(5-Benzo[1,3]dioxol-5-yl-2-ethyl-7-(4-methoxy-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 4.5nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119669(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-met...)copy SMILEScopy InChI
Affinity DataIC50: 5.70nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119675((R)-5-Benzo[1,3]dioxol-5-yl-2-ethylaminomethyl-7-(...)copy SMILEScopy InChI
Affinity DataIC50: 7nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119668((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 8.20nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119663(5-Benzo[1,3]dioxol-5-yl-2-isobutyl-7-(4-methoxy-ph...)copy SMILEScopy InChI
Affinity DataIC50: 8.40nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119661(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pen...)copy SMILEScopy InChI
Affinity DataIC50: 9.10nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119671(5-Benzo[1,3]dioxol-5-yl-2-butyl-7-(4-methoxy-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 11nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119665(5-Benzo[1,3]dioxol-5-yl-2-but-3-enyl-7-(4-methoxy-...)copy SMILEScopy InChI
Affinity DataIC50: 14nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119667((R)-5-Benzo[1,3]dioxol-5-yl-2-(isopropyl-methyl-am...)copy SMILEScopy InChI
Affinity DataIC50: 14nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119666((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 15nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119659((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 21nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119670(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pro...)copy SMILEScopy InChI
Affinity DataIC50: 30nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119678((R)-5-Benzo[1,3]dioxol-5-yl-2-isopropylamino-7-(4-...)copy SMILEScopy InChI
Affinity DataIC50: 42nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119668((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 53nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119676((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 63nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119664((R)-5-Benzo[1,3]dioxol-5-yl-2-but-3-enyl-7-(4-meth...)copy SMILEScopy InChI
Affinity DataIC50: 63nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119674((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 65nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119660(5-Benzo[1,3]dioxol-5-yl-2-ethyl-7-(4-methoxy-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 87nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119669(5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-met...)copy SMILEScopy InChI
Affinity DataIC50: 100nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119666((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...)copy SMILEScopy InChI
Affinity DataIC50: 130nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119673((R)-5-Benzo[1,3]dioxol-5-yl-2-ethoxymethyl-7-(4-me...)copy SMILEScopy InChI
Affinity DataIC50: 140nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin-1 receptor(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119677((R)-5-Benzo[1,3]dioxol-5-yl-2-(2-carboxy-ethyl)-7-...)copy SMILEScopy InChI
Affinity DataIC50: 150nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119662((R)-5-Benzo[1,3]dioxol-5-yl-2-(3-hydroxy-propyl)-7...)copy SMILEScopy InChI
Affinity DataIC50: 190nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119672((5S,7R)-5-(1,3-benzodioxol-5-yl)-7-(4-methoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 410nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119677((R)-5-Benzo[1,3]dioxol-5-yl-2-(2-carboxy-ethyl)-7-...)copy SMILEScopy InChI
Affinity DataIC50: 530nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
TargetEndothelin receptor type B(Homo sapiens (Human))
Tsukuba Research Institute

Curated by ChEMBL
LigandPNGBDBM50119675((R)-5-Benzo[1,3]dioxol-5-yl-2-ethylaminomethyl-7-(...)copy SMILEScopy InChI
Affinity DataIC50: 940nMAssay Description:Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptorMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2KK9B3NPubMed
* indicates data uncertainty>20%