BDBM553940 US11325906, Example 4::US20250289800, Comparative Example 1::US20250346573, Compound AZD5305

SMILES CCC1=Cc2c(cc(cn2)CN3CCN(CC3)c4ccc(nc4)C(=O)NC)NC1=O

InChI Key InChIKey=WQAVGRAETZEADU-UHFFFAOYSA-N

Data  22 IC50  2 Kd  4 EC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 28 hits for monomerid = 553940   

TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 0.310nMAssay Description:Inhibition of PARP-1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 0.526nMAssay Description:1. Test PurposeThis test is used to evaluate the effect of the test compounds on the PARP1 and PARP2 enzyme activities, and the IC50 value of the tes...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2026
Entry Details
US Patent
PDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataKd:  0.550nMAssay Description:Agonist activity at FXR (unknown origin) expressed in human HepG2 cells co-transfected with human RXR assessed as luciferase activity incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 0.650nMAssay Description:Inhibition of PARP-1 (unknown origin) binding to DNA assessed as DNA trapping activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 3nMAssay Description:Displacement of [125I]-glucagon-cex from human glucagon receptor by cell based assay in presence of 0.2% bovine serum albuminMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 3nMAssay Description:Inhibition of human recombinant N-terminal 6His-6Lys-TEV tagged PARP1 full length expressed in pFastBac expression system incubated for 4 hrs by fluo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 4nMAssay Description:Inhibition of PARP-2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 4nMAssay Description:PARP1: Recombinant full length 6HIS tagged PARP1 protein was diluted to 6 nM with 50 mM Tris pH 8, 0.001% Triton X100, 10 mM MgCl2, 150 mM NaCl and i...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent
PDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataEC50:  11nMAssay Description:Agonist activity at FXR (unknown origin) expressed in human HepG2 cells co-transfected with human RXR assessed as luciferase activity incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 21nMAssay Description:1. Test PurposeThis test is used to evaluate the effect of the test compounds on the PARP1 and PARP2 enzyme activities, and the IC50 value of the tes...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2026
Entry Details
US Patent

TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataEC50:  25nMAssay Description:Agonist activity at FXR (unknown origin) expressed in human HepG2 cells co-transfected with human RXR assessed as luciferase activity incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataEC50:  36nMAssay Description:Agonist activity at FXR (unknown origin) expressed in human HepG2 cells co-transfected with human RXR assessed as luciferase activity incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetProtein mono-ADP-ribosyltransferase TIPARP(Human)
Haihe Biopharma Co., Ltd

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 42nMAssay Description:Stabilization of SMURF1 (unknown origin) assessed as decrease in auto-ubiquitination by measuring increase in protein level by cell-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 240nMAssay Description:Inhibition of PARP-2 (unknown origin) binding to DNA assessed as DNA trapping activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataEC50:  415nMAssay Description:Agonist activity at FXR (unknown origin) expressed in human HepG2 cells co-transfected with human RXR assessed as luciferase activity incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 460nMAssay Description:Inhibition of Keap1-Nrf2 (unknown origin) protein-protein interaction expressed in Escherichia coli BL21 codon plus cells using FITC-beta-DEETGEF-OH ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.40E+3nMAssay Description:Inhibition of human microsomal 11beta-HSD2 assessed as inhibition of conversion of radiolabeled cortisone to radiolabeled cortisol by cell-based assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.40E+3nMAssay Description:Inhibition of human recombinant N-terminal Avi-6His-TEV tagged PARP2 full length expressed in pFastBac expression system incubated for 4 hrs by fluor...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.50E+3nMAssay Description:PARP2: Recombinant full length PARP2 protein was diluted to 6 nM with 50 mM Tris pH 8, 0.001% Triton X100, 10 mM MgCl2, 150 mM NaCl and incubated for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent

TargetProtein mono-ADP-ribosyltransferase PARP3(Human)
Haihe Biopharma Co., Ltd

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 3.40E+3nMAssay Description:Stabilization of SMURF1 (unknown origin) assessed as decrease in auto-ubiquitination by measuring increase in protein level by cell-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetProtein mono-ADP-ribosyltransferase PARP3(Human)
Haihe Biopharma Co., Ltd

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 4.70E+3nMAssay Description:PARP3: Recombinant full length PARP3 protein was diluted to 100 nM with 50 mM Tris pH 8, 0.001% Triton X100, 10 mM MgCl2, 150 mM NaCl and incubated f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent

TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
Haihe Biopharma Co., Ltd

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.00E+4nMAssay Description:Stabilization of SMURF1 (unknown origin) assessed as decrease in auto-ubiquitination by measuring increase in protein level by cell-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetProtein mono-ADP-ribosyltransferase PARP10(Human)
Astrazeneca

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataKd: >1.00E+4nMAssay Description:Binding affinity to PARP10 (unknown origin) assessed as apparent dissociation constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of GSK-3beta (unknown origin) assessed as decrease in tau phosphorylation by high content cell based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetProtein mono-ADP-ribosyltransferase PARP6(Human)
Astrazeneca

US Patent
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.90E+4nMAssay Description:PARP6: Recombinant full length GST tagged PARP6 protein was diluted to 160 nM with 50 mM Tris pH 8, 0.001% Triton X100, 10 mM MgCl2, 150 mM NaCl and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 4.00E+4nMAssay Description:Electrophysiological recordings (all performed at RT) from stably transfected CHO hKv11.1 cells were obtained using the Nanion Syncropatch 768PE. Tes...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of human ERGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Human)
Haihe Biopharma Co., Ltd

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 553940BDBM553940(US11325906, Example 4 | US20250289800, Comparative...)
Affinity DataIC50: 1.00E+5nMAssay Description:PARP5a: Recombinant PARP5a binding domain was diluted to 160 nM with 50 mM Tris pH 8, 0.001% Triton X100, 10 mM MgCl2, 150 mM NaCl and incubated for ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2022
Entry Details
US Patent