Compile Data Set for Download or QSAR

Found 16 hits of Enzyme Inhibition Constant Data   

TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50108052(1-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-2,4-dimethoxy...)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179338(CHEMBL3814495)copy SMILEScopy InChI
Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179252(CHEMBL3815143)copy SMILEScopy InChI
Affinity DataIC50: 7.00E+3nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179290(CHEMBL3814750)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179290(CHEMBL3814750)copy SMILEScopy InChI
Affinity DataIC50: 1.80E+4nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM23926((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)copy SMILEScopy InChI
Affinity DataIC50: 3.40E+4nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50108046((oxyresveratrol)4-[(E)-2-(3,5-dihydroxyphenyl)viny...)copy SMILEScopy InChI
Affinity DataIC50: 3.40E+4nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM23926((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)copy SMILEScopy InChI
Affinity DataIC50: 5.50E+4nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179252(CHEMBL3815143)copy SMILEScopy InChI
Affinity DataIC50: 6.30E+4nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179356(CHEMBL3815038)copy SMILEScopy InChI
Affinity DataIC50: 8.20E+4nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179338(CHEMBL3814495)copy SMILEScopy InChI
Affinity DataIC50: 1.15E+5nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50145829(4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...)copy SMILEScopy InChI
Affinity DataIC50: 1.20E+5nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179288(CHEMBL3814820)copy SMILEScopy InChI
Affinity DataIC50: 1.20E+5nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179288(CHEMBL3814820)copy SMILEScopy InChI
Affinity DataIC50: 1.63E+5nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1A1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179355(CHEMBL3814999)copy SMILEScopy InChI
Affinity DataIC50: 1.67E+5nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
TargetCytochrome P450 1B1(Homo sapiens (Human))
Whittier College

Curated by ChEMBL
LigandPNGBDBM50179355(CHEMBL3814999)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XG9T1MPubMed
* indicates data uncertainty>20%