BDBM50584227 CHEMBL5087431::US20240327418, Example LEE17

SMILES CCCNNC(=O)c1ccc(CNC(=O)c2cc3ccccc3s2)cc1

InChI Key InChIKey=DOCUUNQBCZHNKR-UHFFFAOYSA-N

Data  7 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50584227   

TargetPlatelet-derived growth factor receptor alpha/beta(Mouse)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 0.550nMAssay Description:Inhibition of C-terminal His-tagged human HDAC3 (1 to 428 residues)/N-terminal GST tagged human NCOR2 (395 to 489 residues) expressed in baculovirus-...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetHistone deacetylase 3(Human)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 0.550nMAssay Description:Inhibition of human recombinant HDAC3 using Boc-Lys(acetyl)-AMC substrate incubated for 2 hrs by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetHistone deacetylase 3(Human)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 0.551nMAssay Description:a) Formulation of 100% solution: 50 μL of HDAC buffer was mixed with 10 μL of enzyme solution, 40 μL of substrate was added after 5 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/3/2025
Entry Details
US Patent

TargetHistone deacetylase 1(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 3.79nMAssay Description:a) Formulation of 100% solution: 50 μL of HDAC buffer was mixed with 10 μL of enzyme solution, 40 μL of substrate was added after 5 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/3/2025
Entry Details
US Patent

TargetHistone deacetylase 1(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 3.80nMAssay Description:Inhibition of human recombinant HDAC1 using Boc-Lys(acetyl)-AMC substrate incubated for 2 hrs by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 3.80nMAssay Description:Inhibition of C-terminal 6XHis-tagged/FLAG-tagged full length human recombinant HDAC1 (1 to 482 residues) expressed in baculovirus-infected Sf9 cells...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetHistone deacetylase 2(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 16.9nMAssay Description:a) Formulation of 100% solution: 50 μL of HDAC buffer was mixed with 10 μL of enzyme solution, 40 μL of substrate was added after 5 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/3/2025
Entry Details
US Patent

TargetHistone deacetylase 2(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 17nMAssay Description:Inhibition of human recombinant HDAC2 using Boc-Lys(acetyl)-AMC substrate incubated for 2 hrs by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Ocean University of China

US Patent
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 17nMAssay Description:Inhibition of C-terminal 6XHis-tagged full length human recombinant HDAC2 (1 to 488 residues) expressed in baculovirus-infected Sf9 cells using Boc-L...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetHistone deacetylase 6(Human)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC6 using Boc-Lys(acetyl)-AMC substrate incubated for 2 hrs by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetNicotinamide phosphoribosyltransferase(Human)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50584227(CHEMBL5087431 | US20240327418, Example LEE17)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged human recombinant NAMPT (2 to 491 residues) expressed in Escherichia coli expression system incubated for 30 mins...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed