BDBM50561993 CHEMBL4744636

SMILES COc1nc2ccccc2cc1-c1cnc([nH]1)[C@H](CCCCNC(=O)c1ccccc1SC)NC(=O)c1cncs1

InChI Key InChIKey=PDHUHMPWDWKFCL-UHFFFAOYSA-N

Data  4 IC50

  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 4 hits for monomerid = 50561993   

TargetHistone deacetylase 3(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50561993(CHEMBL4744636)
Affinity DataIC50: 114nMAssay Description:Inhibition of human recombinant full length FLAG-tagged HDAC3 expressed in HEK293F cells in using BML-KI104 as substrate in presence of SAHA as inhib...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
LigandPNGBDBM50561993(CHEMBL4744636)
Affinity DataIC50: 1.33E+3nMAssay Description:Inhibition of human ERGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50561993(CHEMBL4744636)
Affinity DataIC50: 4.50E+4nMAssay Description:Inhibition of human recombinant full length FLAG-tagged HDAC2 expressed in baculovirus infected Sf9 cells using BML-KI104 as substrate in presence of...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Merck

Curated by ChEMBL
LigandPNGBDBM50561993(CHEMBL4744636)
Affinity DataIC50: 4.50E+4nMAssay Description:Inhibition of human recombinant full length FLAG-tagged HDAC1 expressed in HEK293F cells using BML-KI104 as substrate in presence of SAHA as inhibito...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed