BDBM27502 3,4-dihydro-5-(4-(1-piperidinyl)butoxy)-1(2H)-isoquinolinone::5-[4-(piperidin-1-yl)butoxy]-1,2,3,4-tetrahydroisoquinolin-1-one::CHEMBL127336::DPQ

SMILES c1cc2c(c(c1)OCCCCN3CCCCC3)CCNC2=O

InChI Key InChIKey=RVOUDNBEIXGHJY-UHFFFAOYSA-N

Data  6 IC50

PDB links: 1 PDB ID matches 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 6 hits for monomerid = 27502   

TargetPoly [ADP-ribose] polymerase 1(Human)
University of Konstanz

LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 372nMpH: 7.8 T: 2°CAssay Description:The enzymatic reaction of the recombinant PARP was quantified by SPA. Radioactivity incorporated from [3H]NAD+ into PAR, and then being captured by P...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/9/2009
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 2(Mouse)
University of Konstanz

LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 1.74E+3nMpH: 7.8 T: 2°CAssay Description:The enzymatic reaction of the recombinant PARP was quantified by SPA. Radioactivity incorporated from [3H]NAD+ into PAR, and then being captured by P...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/9/2009
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
University of Konstanz

LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 53nMAssay Description:Inhibition of PARP1 (unknown origin) in presence of NAD+ by homogenous fluorescence plate assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/3/2016
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
University of Konstanz

LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 1.08E+4nMAssay Description:Inhibition of PARP1More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed
TargetTransient receptor potential cation channel subfamily M member 2(Human)
Queen'S Center For Biomedical Research

Curated by ChEMBL
LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 600nMAssay Description:Inhibition of human FLAG-tagged TRPM2 expressed in HEK293 cells assessed as reduction in H2O2-induced intracellular calcium flux pretreated for 30 se...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2020
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
University of Konstanz

LigandPNGBDBM27502(CHEMBL127336 | 3,4-dihydro-5-(4-(1-piperidinyl)but...)
Affinity DataIC50: 150nMAssay Description:Inhibition of PARP1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed