BDBM50106187 Benzenecarboxamide::Benzoic acid amide::Benzoylamide::CHEMBL267373::Phenylcarboxamide::Phenylcarboxyamide::benzamide

SMILES NC(=O)c1ccccc1

InChI Key InChIKey=KXDAEFPNCMNJSK-UHFFFAOYSA-N

Data  3 KI  4 IC50  1 ITC

PDB links: 9 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50106187   

TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataIC50:  5.40E+3nMAssay Description:Inhibition of PARP-1 using [32P]-NAD+ after 15 minsMore data for this Ligand-Target Pair
TargetPoly(ADP-ribose) glycohydrolase(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of PARG using [alpha-32P]ADP-ribose polymers after 5 mins by TRAP assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataIC50:  2.20E+4nMAssay Description:The compound was tested for poly(ADP-ribose)polymerase (PARP) inhibitionMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataIC50:  2.00E+4nMAssay Description:Inhibitory activity against Poly (ADP-ribose) polymerase 1More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50106187   

HostPNGBDBM36284(BDBM36303 | BDBM36310 | Methyl Viologen-Cucurbit[8...)
University of Cambridge

GuestPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
ITC DataΔG°: -5.63kcal/mole logk: 1.30E+4
pH: 7.0 T: 25.00°C