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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase EHMT1' and Ligand = 'BDBM50501532'   
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 EHMT1


(Homo sapiens (Human))		BDBM50501532
PNG
(CHEMBL4067656)
Show SMILES COc1cc2nc(nc(NC3CCN(C)CC3)c2cc1OC)C1CCCCC1
Show InChI InChI=1S/C22H32N4O2/c1-26-11-9-16(10-12-26)23-22-17-13-19(27-2)20(28-3)14-18(17)24-21(25-22)15-7-5-4-6-8-15/h13-16H,4-12H2,1-3H3,(H,23,24,25)
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n/an/a 34n/an/an/an/an/an/a



Icahn School of Medicine at Mount Sinai

Curated by ChEMBL


Assay Description
Inhibition of recombinant GLP catalytic SET domain (982 to 1266 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) codon plus RIL as...

J Med Chem 60: 1876-1891 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01645
BindingDB Entry DOI: 10.7270/Q2ZP4947
More data for this
Ligand-Target Pair