BDBM699115 US20240327418, Example LEE18

SMILES CCCNNC(=O)c1ccc(CNC(=O)c2cc3cnccc3[nH]2)cc1

InChI Key InChIKey=AAJJDOFESDDARD-UHFFFAOYSA-N

Data  4 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 15 hits for monomerid = 699115   

TargetHistone deacetylase 3(Human)
Ocean University of China

US Patent
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 0.710nMAssay 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

LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 0.720nMAssay 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:
TBA
Entry Details
PubMed
TargetHistone deacetylase 1(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 7.60nMAssay 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:
TBA
Entry Details
PubMed
TargetHistone deacetylase 1(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 7.61nMAssay 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
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 37.8nMAssay 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
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 38nMAssay 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:
TBA
Entry Details
PubMed
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.62E+3nMAssay 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:
TBA
Entry Details
PubMed
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.62E+3nMAssay 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 9(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal His-tagged human recombinant HDAC9 (604 to 1066 residues) expressed in baculovirus-infected Sf9 cells using Boc-Lys-(trifluo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 8(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal His-tagged full length human recombinant HDAC8 (1 to 377 residues) expressed in baculovirus-infected Sf9 cells using Boc-Lys...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 11(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of full length human recombinant HDAC11 (1 to 347 residues) expressed in baculovirus-infected Sf9 cells using Boc-Lys-(trifluoroacetyl)-AM...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 5(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal His-tagged human HDAC5 catalytic domain (656 to 1122 residues) expressed in baculovirus-infected Sf9 cells using Boc-Lys-(tr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 4(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal His-tagged/N-terminal GST-tagged human HDAC4 (627 to 1084 residues) expressed in baculovirus-infected Sf9 cells using Boc-Ly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 7(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged human HDAC7 (518 to end residues) expressed in baculovirus-infected Sf9 cells using Boc-Lys-(trifluoroacetyl)-AMC...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed
TargetHistone deacetylase 6(Human)TBA
LigandPNGBDBM699115(US20240327418, Example LEE18)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged human full length recombinant HDAC6 (1 to 1215 residues) expressed in baculovirus-infected Sf9 cells using Boc-Ly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
TBA
Entry Details
PubMed