BDBM50645140 CHEMBL5590745

SMILES O=C(CCCCCOc1ccc(-c2sc3cc(O)ccc3c2C(=O)c2ccc(OCCN3CCCCC3)cc2)cc1)NO

InChI Key InChIKey=YYTVHUNDYNUXIM-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 = 50645140   

TargetHistone deacetylase 1(Human)
McGill University

Curated by ChEMBL
LigandPNGBDBM50645140(CHEMBL5590745)
Affinity DataIC50: 132nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetHistone deacetylase 6(Human)
McGill University

Curated by ChEMBL
LigandPNGBDBM50645140(CHEMBL5590745)
Affinity DataIC50: 21nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetEstrogen receptor(Human)
McGill University

Curated by ChEMBL
LigandPNGBDBM50645140(CHEMBL5590745)
Affinity DataIC50: 373nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed