BDBM50288516 CHEMBL4159240

SMILES CC(C)(C)OC(=O)N1CCC2(CCN(C(=O)c3cc(Cc4n[nH]c(=O)c5ccccc45)ccc3F)C2)C1

InChI Key InChIKey=MOYOUBMGSIHZJF-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50288516   

TargetPoly [ADP-ribose] polymerase tankyrase-2(Human)
University of Pennsylvania

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50288516BDBM50288516(CHEMBL4159240)
Affinity DataIC50: 576nMAssay Description:Inhibition of human N-terminal GST-tagged TNKS2 (667 to 1166 residues) expressed in baculovirus infected sf9 cells using histone as substrate after 1...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2020
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
University of Pennsylvania

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50288516BDBM50288516(CHEMBL4159240)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of human N-terminal GST-tagged TNKS1 (1001 to 1327 residues) expressed in baculovirus infected sf9 cells using histone as substrate after ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2020
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
University of Pennsylvania

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50288516BDBM50288516(CHEMBL4159240)
Affinity DataIC50: 4.40E+3nMAssay Description:Binding affinity to PARP1 in human OVCAR8 cells assessed as reduction in [125I]-KX1 binding by gamma counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2020
Entry Details Article
PubMed