BDBM50244778 CHEMBL4086442

SMILES CCCNNC(=O)c1ccc(CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccc(OC)cc2)cc1

InChI Key InChIKey=LYUHXLDJCYYUNT-UHFFFAOYSA-N

Data  16 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 16 hits for monomerid = 50244778   

TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 5.60nMAssay Description:Inhibition of full length recombinant human C-terminal His-tagged HDAC3/N-terminal GST-tagged NCOR2 co-expressed in baculovirus expression system usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 5.70nMAssay Description:Inhibition of full length recombinant human C-terminal His-tagged HDAC3/N-terminal GST-tagged NCOR2 co-expressed in baculovirus expression system usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 8.5nMAssay Description:Inhibition of full length recombinant human C-terminal His-tagged HDAC3/N-terminal GST-tagged NCOR2 co-expressed in baculovirus expression system usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 14nMAssay Description:Inhibition of full length recombinant human C-terminal His-tagged HDAC3/N-terminal GST-tagged NCOR2 co-expressed in baculovirus expression system usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 18nMAssay Description:Inhibition of full length recombinant human C-terminal His-tagged HDAC3/N-terminal GST-tagged NCOR2 co-expressed in baculovirus expression system usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 33nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC1 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 50nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC1 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 63nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC1 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 78nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC1 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 91nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC1 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 194nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC2 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 260nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC2 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 287nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC2 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 367nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC2 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 424nMAssay Description:Inhibition of full length recombinant human C-terminal FLAG/His-tagged HDAC2 expressed in baculovirus expression system using Boc-Lys(acetyl)-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed
TargetHistone deacetylase 6(Human)
Medical University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50244778(CHEMBL4086442)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of HDAC6 (unknown origin) using Boc-Lys(acetyl)-AMC as substrate preincubated for 1 hr followed by substrate addition measured after 2 hrs...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/24/2019
Entry Details Article
PubMed