null

SMILES NC(=O)c1cccc2nc([nH]c12)-c1ccccc1

InChI Key InChIKey=OBBJGEVEIULNEO-UHFFFAOYSA-N

PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 27091   

TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University of Newcastle

Curated by ChEMBL
LigandPNGBDBM27091(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)copy SMILEScopy InChI
Affinity DataKi:  15nMAssay Description:Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2542N1MPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University of Newcastle

Curated by ChEMBL
LigandPNGBDBM27091(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)copy SMILEScopy InChI
Affinity DataKi:  15nMAssay Description:In vitro inhibition against human full length PARP proteinMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2MP52HJPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University of Newcastle

Curated by ChEMBL
LigandPNGBDBM27091(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)copy SMILEScopy InChI
Affinity DataKi:  17nMAssay Description:Inhibition of PARP1 using [3H]NAD+ by top count scintillation countingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2N879XRPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University of Newcastle

Curated by ChEMBL
LigandPNGBDBM27091(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)copy SMILEScopy InChI
Affinity DataKi:  17nM ΔG°:  -10.5kcal/molepH: 8.0 T: 2°CAssay Description:PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JD4V3XPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
University of Newcastle

Curated by ChEMBL
LigandPNGBDBM27091(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)copy SMILEScopy InChI
Affinity DataEC50:  75nMAssay Description:Inhibition of PARP1 in human C41 cells by FITC-conjugated DAPI stainingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2N879XRPubMed