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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase EZH2' and Ligand = 'BDBM326143'   
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 EZH2


(Homo sapiens (Human))
BDBM326143
PNG
(US10273223, Compound D-41 | US9637472, Compound D-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCNCC2)c(=O)[nH]1 |t:27|
Show InChI InChI=1S/C26H31N5O2/c1-16-11-17(2)30-26(33)22(16)14-28-25(32)21-12-19(18-7-9-27-10-8-18)13-24-23(21)15-29-31(24)20-5-3-4-6-20/h7,11-13,15,20,27H,3-6,8-10,14H2,1-2H3,(H,28,32)(H,30,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<300n/an/an/an/an/an/a



IRBM/Merck



Assay Description
eneral Procedure for Wild-Type PRC2 Enzyme Assay on Oligonucleosome Substrate. The assays was performed in a buffer consisting of 20 mM bicine (pH=7....


J Med Chem 51: 2350-3 (2008)


BindingDB Entry DOI: 10.7270/Q28P62V9
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM326143
PNG
(US10273223, Compound D-41 | US9637472, Compound D-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCNCC2)c(=O)[nH]1 |t:27|
Show InChI InChI=1S/C26H31N5O2/c1-16-11-17(2)30-26(33)22(16)14-28-25(32)21-12-19(18-7-9-27-10-8-18)13-24-23(21)15-29-31(24)20-5-3-4-6-20/h7,11-13,15,20,27H,3-6,8-10,14H2,1-2H3,(H,28,32)(H,30,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<300n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Recombinant PRC2 Enzymes. Human PRC2 enzymes were purified as 4-component enzyme complexes co-expressed in Spodoptera frugiperda (sf9) cells using a ...


US Patent US9637472 (2017)


BindingDB Entry DOI: 10.7270/Q2X0693B
More data for this
Ligand-Target Pair