BDBM50067906 (3-aminophenyl)boronic acid, 1::3-aminophenyl boronic acid::3-aminophenylboronic acid::Aza-boronic acid derivative::Boronic acid derivative::CHEMBL20852::M-AMINOPHENYLBORONIC ACID

SMILES Nc1cccc(c1)B(O)O

InChI Key InChIKey=JMZFEHDNIAQMNB-UHFFFAOYSA-N

Data  8 KI  1 IC50

PDB links: 3 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 9 hits for monomerid = 50067906   

LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataIC50: 1.26E+4nMAssay Description:Inhibition of full length human C-terminal 6-His-tagged ATXbeta using FS-3 as substrate preincubated for 20 mins followed by substrate addition by fl...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-lactamase(Escherichia coli (strain K12))
Northwestern University

LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  7.30E+3nMpH: 7.0Assay Description:Inhibition assay against beta lactamase enzymes.More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetBeta-lactamase(Escherichia coli (strain K12))
Northwestern University

LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  7.30E+3nMAssay Description:Inhibitory activity against Escherichia coli AmpC beta-lactamase.More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetBeta-lactamase(Escherichia coli (strain K12))
Northwestern University

LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  7.30E+3nMAssay Description:Apparent inhibition constant against Escherichia coli AmpC beta-lactamaseMore data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetSubtilisin BL(Bacillus lentus)
TBA

Curated by ChEMBL
LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  7.30E+4nMAssay Description:Competitive inhibition of Subtilisin BL M222S-mutated enzyme from Bacillus lentusMore data for this Ligand-Target Pair
In DepthDetails Article

TargetSubtilisin Carlsberg(Bacillus licheniformis)
TBA

Curated by ChEMBL
LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  7.50E+4nMAssay Description:Competitive inhibition of Subtilisin Carlsberg enzyme from Bacillus lentusMore data for this Ligand-Target Pair
In DepthDetails Article

TargetBeta-lactamase TEM(Escherichia coli)
TBA

Curated by ChEMBL
LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  3.70E+6nMAssay Description:Inhibitory constant was determined against class A RTEM-1 Beta-lactamase from Escherichia coliMore data for this Ligand-Target Pair
In DepthDetails Article

TargetSubtilisin BL(Bacillus lentus)
TBA

Curated by ChEMBL
LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  2.04E+5nMAssay Description:Competitive inhibition of Subtilisin BL M222C-mutated enzyme from Bacillus lentusMore data for this Ligand-Target Pair
In DepthDetails Article

TargetSubtilisin BL(Bacillus lentus)
TBA

Curated by ChEMBL
LigandPNGBDBM50067906((3-aminophenyl)boronic acid, 1 | 3-aminophenyl bor...)
Affinity DataKi:  1.50E+5nMAssay Description:Competitive inhibition of Subtilisin BL wild type enzyme from Bacillus lentusMore data for this Ligand-Target Pair
In DepthDetails Article