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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase EHMT2' and Ligand = 'BDBM50512639'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))		BDBM50512639
PNG
(CHEMBL4476055)
Show SMILES COc1cc2c(NC3CCN(C)CC3)nc(nc2cc1NC(=O)CCN)N1CCCN(C)CC1
Show InChI InChI=1S/C24H38N8O2/c1-30-9-4-10-32(14-13-30)24-28-19-16-20(27-22(33)5-8-25)21(34-3)15-18(19)23(29-24)26-17-6-11-31(2)12-7-17/h15-17H,4-14,25H2,1-3H3,(H,27,33)(H,26,28,29)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 447n/an/an/an/an/an/a



Mercachem BV

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST tagged human recombinant EHMT2 (785 to 1210 residues) expressed in baculovirus infected Sf9 insect cells assessed as red...

Bioorg Med Chem Lett 29: 2516-2524 (2019)


Article DOI: 10.1016/j.bmcl.2019.06.012
BindingDB Entry DOI: 10.7270/Q2ZW1Q8X
More data for this
Ligand-Target Pair