BDBM50640768 CHEMBL5589873

SMILES CCS(=O)(=O)Nc1cc(-c2cc(NC3CCNCC3)c(=O)n(C)c2)cc2c1ccn2C(C)(c1ccccn1)c1ccccn1

InChI Key InChIKey=RDWRDUFEWMSPGQ-UHFFFAOYSA-N

Data  2 IC50  10 Kd

PDB links: 2 PDB IDs match 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 12 hits for monomerid = 50640768   

TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  8.90nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  1.65E+3nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataIC50: 12nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataIC50: 3.11E+3nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain-containing protein 2(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  28nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetBromodomain-containing protein 2(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  1.60E+3nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetBromodomain-containing protein 3(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  14nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetBromodomain-containing protein 3(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  2.39E+3nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  10nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain-containing protein 4(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  826nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBromodomain testis-specific protein(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  10nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetBromodomain testis-specific protein(Human)
University of Illinois at Chicago

Curated by ChEMBL
LigandPNGBDBM50640768(CHEMBL5589873)
Affinity DataKd:  3.73E+3nMMore data for this Ligand-Target Pair
Ligand InfoPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed