BDBM50507295 CHEMBL1232432

SMILES COc1cc2nc(NCCCN(C)C)nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC

InChI Key InChIKey=YYFDMPHIONBOKZ-UHFFFAOYSA-N

Data  2 KI  1 IC50  5 Kd

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50507295   

TargetREST corepressor 1(Homo sapiens (Human))
Sapienza University Of Rome

Curated by ChEMBL

LigandBDBM50507295(CHEMBL1232432)Copy SMILESCopy InChI

Affinity DataKi:  440nMAssay Description:Inhibition of human LSD1/CoREST using histone H3 peptide as substrate by fluorescence polarization assayMore data for this Ligand-Target Pair

Target InfoPDBReactome pathway
UniProtKB/SwissProt
antibodypediaGoogleScholar

Ligand InfoPurchasePC cidPC sidPDB

In DepthDetails PubMedPDB3D Structure (crystal)
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TargetHistone-lysine N-methyltransferase EHMT2(Homo sapiens (Human))
Sapienza University Of Rome

Curated by ChEMBL

LigandBDBM50507295(CHEMBL1232432)Copy SMILESCopy InChI

Affinity DataKi:  680nMAssay Description:Inhibition of G9a (unknown origin) assessed as reduction in substrate methylation using histone H3 and SAM as substrate measured after 15 to 60 mins ...More data for this Ligand-Target Pair

Target InfoPDBReactome pathway
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPurchasePC cidPC sidPDB

In DepthDetails PubMed
Copy BDB DOI