BDBM7942 1-Subsituted 1H-imidazole, 8::1-Vinylimidazole::1-ethenyl-1H-imidazole::Imidazole N-1 deriv. 3::US9138393, 1-Vinylimidazole::US9144538, 1-Vinylimidazole

SMILES C=Cn1ccnc1

InChI Key InChIKey=OSSNTDFYBPYIEC-UHFFFAOYSA-N

Data  1 KI  4 IC50

PDB links: 2 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 7942   

TargetGlutaminyl-peptide cyclotransferase(Homo sapiens (Human))
Probiodrug

LigandPNGBDBM7942(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
Affinity DataKi:  4.90E+4nM ΔG°:  -5.97kcal/molepH: 8.0 T: 2°CAssay Description:QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...More data for this Ligand-Target Pair
TargetCytochrome P450 3A4(Homo sapiens (Human))
The Procter & Gamble

US Patent
LigandPNGBDBM7942(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
Affinity DataIC50: >1.00E+4nMAssay Description:Cytochrome P450 is a large and diverse group of enzymes that catalyze the oxidation of organic substances. Some members of the CYP family contribute ...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetCytochrome P450 3A4(Homo sapiens (Human))
The Procter & Gamble

US Patent
LigandPNGBDBM7942(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
Affinity DataIC50: >1.00E+4nMAssay Description:A commercially available P450-GLO Assay kit (Promega Corporation, Madison Wis.) is used to screen various compounds for CYP3A4A inhibition activity. ...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetCytochrome P450 2A6(Homo sapiens (Human))
University Of Basel

LigandPNGBDBM7942(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
Affinity DataIC50: >3.00E+5nMpH: 7.6 T: 2°CAssay Description:Inhibition assay using cytochrome P450 enzyme CYP2A6 and CYP2A13.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2A13(Homo sapiens (Human))
University Of Basel

LigandPNGBDBM7942(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
Affinity DataIC50: >3.00E+5nMpH: 7.6 T: 2°CAssay Description:Inhibition assay using cytochrome P450 enzyme CYP2A6 and CYP2A13.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed