BDBM50065935 CHEMBL98797::NOB::Nitrosobenzene (Substrate 1)::nitrosobenzene

SMILES c1ccc(cc1)N=O

InChI Key InChIKey=NLRKCXQQSUWLCH-UHFFFAOYSA-N

Data  2 IC50

PDB links: 6 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50065935   

Target1-deoxy-D-xylulose-5-phosphate synthase(Escherichia coli (strain K12))
The Johns Hopkins University

LigandPNGBDBM50065935(NOB | CHEMBL98797 | Nitrosobenzene (Substrate 1) |...)
Affinity DataIC50: 2.08E+5nMpH: 8.0 T: 2°CAssay Description:Reaction mixtures containing HEPES (100mM, pH 8.0, 2mM MgCl2, 5mM NaCl), ThDP (1mM), BSA (1mg/mL), DMSO (10%, v/v), ᴅ-GAP (30µM), pyruvate...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/1/2014
Entry Details Article
PubMed
TargetAldehyde dehydrogenase 1A1(Rat)
St. Cloud State University

Curated by ChEMBL
LigandPNGBDBM50065935(NOB | CHEMBL98797 | Nitrosobenzene (Substrate 1) |...)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibitory activity against yeast aldehyde dehydrogenase (AIDH)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed