null

SMILES Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N)c1nnc(C)n-21)c1ccc(Cl)cc1

InChI Key

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 8 hits for monomerid = 50587649   

TargetHistone deacetylase 1(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 290nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RN3CS0PubMed
TargetBromodomain-containing protein 4(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 720nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetBromodomain-containing protein 4(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 74nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetBromodomain-containing protein 4(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataKd:  69nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetBromodomain-containing protein 4(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 74nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetHistone deacetylase 1(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 290nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2K07870PubMed
TargetBromodomain-containing protein 4(Homo sapiens (Human))TBA
LigandPNGBDBM50587649(CHEMBL5197137)copy SMILES
Affinity DataIC50: 720nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB