BDBM50593627 CHEMBL5199558

SMILES Cc1ccc2n1cc([nH]c2=O)-c1ccc(cc1)C(C)(C)O

InChI Key InChIKey=MPXAEYSGFKRDQM-UHFFFAOYSA-N

Data  22 IC50  1 Kd

  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 23 hits for monomerid = 50593627   

LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 110nMAssay Description:Inhibition of N-terminal GST-fused human recombinant PARP3 (2 to 540 residues) expressed in Sf9 insect cells by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetCytochrome P450 4B1(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP450 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of A3 adenosine receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetSodium-dependent dopamine transporter(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.90E+4nMAssay Description:Inhibition of dopamine transporter (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged human recombinant PARP15 (221 to 444 residues) expressed in Escherichia coli by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST/6xHis/TEV-tagged human recombinant PARP14 (1470 to 1801 residues) expressed in Sf9 insect cells by chemiluminescence ass...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 2.60E+3nMAssay Description:Inhibition of human PARP12 by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 67nMAssay Description:Inhibition of N-terminal GST-tagged/C-terminal 6xHis-tagged human recombinant PARP11 (8 to 338 residues) expressed in Sf9 insect cells by chemilumine...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 2.90E+3nMAssay Description:Inhibition of human PARP10 by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of human PARP8 by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 330nMAssay Description:Inhibition of N-terminal FLAG-tagged human recombinant PARP7 (400 to 657 residues) expressed in Sf9 insect cells by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 2.60E+3nMAssay Description:Inhibition of N-terminal GST-tagged human recombinant PARP6 (1 to 630 residues) expressed in Sf9 insect cells by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
University of South Australia

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 0.600nMAssay Description:Inhibition of GST-tagged TNKS1 (1023 - 1327 residues) (unknown origin) by ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 200nMAssay Description:Inhibition of N-terminal GST-tagged human recombinant PARP2 (2 to 583 residues) expressed in baculovirus infected Sf9 insect cells by chemiluminescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 140nMAssay Description:Inhibition of N-terminal GST-tagged human recombinant PARP1 (2 to 1014 residues) expressed in Sf9 insect cells by chemiluminescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.40nMAssay Description:Inhibition of TNKS2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
University of South Australia

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 1.30nMAssay Description:Inhibition of TNKS1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
University of South Australia

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataKd: <2nMAssay Description:Binding affinity to recombinant human TNKS1 (1091 to 1327 residues) assessed as dissociation constant by ITC methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 928nMAssay Description:Inhibition of PARP-1 (unknown origin) using biotinylated NAD and NAD as substrate assessed as inhibition of auto-PARsylation incubated for 150 mins b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 0.900nMAssay Description:Inhibition of TNKS2 (unknown origin) using biotinylated NAD as substrate assessed as inhibition of autoPARsylation activity incubated for 1 hr by ELI...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
University of South Australia

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 0.600nMAssay Description:Inhibition of TNKS1 (unknown origin) using biotinylated NAD as substrate assessed as inhibition of autoPARsylation activity incubated for 1 hr by ELI...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 928nMAssay Description:Inhibition of PARP1 (unknown origin) by fluorescence based multimode plate reader methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
LigandPNGBDBM50593627(CHEMBL5199558)
Affinity DataIC50: 0.900nMAssay Description:Inhibition of GST-tagged TNKS2 (873 - 1166 residues) (unknown origin) by ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed