BDBM50652788 CHEMBL4791017

SMILES COc1cc(OC)cc(-c2noc(N3CCN(C)C4(CCN(c5ccnc(C)c5)CC4)C3)n2)c1

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 = 50652788   

TargetHistone-lysine N-methyltransferase PRDM9(Homo sapiens)
University of Toronto

Curated by ChEMBL
LigandPNGBDBM50652788(CHEMBL4791017)
Affinity DataKi:  65nMAssay Description:Competitive inhibition of PRDM9 (unknown origin) assessed as inhibition constant in presence of varying concentration of SAM and peptide substrateMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetHistone-lysine N-methyltransferase PRDM9(Homo sapiens)
University of Toronto

Curated by ChEMBL
LigandPNGBDBM50652788(CHEMBL4791017)
Affinity DataIC50: 80nMAssay Description:Inhibition of PRDM9 (unknown origin) (195 to 415 residues) using biotin-tagged Histone H3 (1 to 25) and 3H-SAM as substrate incubated for 30 mins by ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetHistone-lysine N-methyltransferase PRDM9(Homo sapiens)
University of Toronto

Curated by ChEMBL
LigandPNGBDBM50652788(CHEMBL4791017)
Affinity DataKd:  87nMAssay Description:Binding affinity to PRDM9 (unknown origin) (195 to 415 residues) assessed as dissociation constant measured at 60 to 120 secs in presence of SAM by b...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetHistone-lysine N-methyltransferase PRDM9(Homo sapiens)
University of Toronto

Curated by ChEMBL
LigandPNGBDBM50652788(CHEMBL4791017)
Affinity DataIC50: 800nMAssay Description:Inhibition of FLAG tagged PRDM9 transfected in HEK293T cells assessed as reduction in trimethylation of ectopic H3K4 measured after 20 hrs by Western...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetHistone-lysine N-methyltransferase PRDM7(Homo sapiens)
University of Toronto

Curated by ChEMBL
LigandPNGBDBM50652788(CHEMBL4791017)
Affinity DataIC50: 4.50E+4nMAssay Description:Inhibition of PRDM7 (unknown origin) using biotin-tagged Histone H3 (1 to 25) and 3H-SAM as substrate incubated for 90 mins by topcount plate reader ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed