BDBM50648735 CHEMBL5613964

SMILES C#CCN1CCN(CCCOc2ccc3c(ccn3S(=O)(=O)c3ccc(C(=O)NNCCC)cc3)c2)CC1

InChI Key

  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 5 hits for monomerid = 50648735   

TargetHistone deacetylase 1(Human)
Institute of General Organic Chemistry (CSIC)

Curated by ChEMBL
LigandPNGBDBM50648735(CHEMBL5613964)
Affinity DataIC50: 137nMAssay Description:Inhibition of C-terminal 6His/FLAG tagged full length human recombinant HDAC1 (1 to 482 residues) extracted from Sf9 cells using Z-Lys(Ac)-AMC as sub...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
Institute of General Organic Chemistry (CSIC)

Curated by ChEMBL
LigandPNGBDBM50648735(CHEMBL5613964)
Affinity DataIC50: 384nMAssay Description:Inhibition of human recombinant MAO-B using para-tyramine as substrate by Amplex Red fluorimetric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetCholinesterase(Horse)
Institute of General Organic Chemistry (CSIC)

Curated by ChEMBL
LigandPNGBDBM50648735(CHEMBL5613964)
Affinity DataIC50: 8.81E+3nMAssay Description:Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition and measured aft...More 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)
Institute of General Organic Chemistry (CSIC)

Curated by ChEMBL
LigandPNGBDBM50648735(CHEMBL5613964)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST tagged full length human recombinant HDAC6 (1 to 1215 residues) extracted from Sf9 cells using Z-Lys(Ac)-AMC as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
Target5-hydroxytryptamine receptor 6(Human)
Institute of General Organic Chemistry (CSIC)

Curated by ChEMBL
LigandPNGBDBM50648735(CHEMBL5613964)
Affinity DataKi:  3.07E+4nMAssay Description:Displacement of [3H]-LSD from human 5-HT6 receptor extracted from CHO-K1 cell membrane assessed as inhibition constant incubated for 1 hr by Microbet...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed