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SMILES: CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ncccc12

InChI Key:

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 574917   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/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))		BDBM574917
PNG
(2-methyl-N-((6-methyl-4-(methylthio)-2-oxo-1,2-dih...)
Show SMILES CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ncccc12 |wU:18.19,wD:20.26,(2.54,-2.14,;4.03,-2.54,;4.42,-4.02,;5.91,-4.42,;6.31,-5.91,;7.8,-6.31,;5.22,-7,;3.73,-6.6,;2.64,-7.69,;3.33,-5.11,;1.85,-4.71,;1.45,-3.23,;-.04,-2.83,;-1.13,-3.92,;-.51,-1.36,;.39,-.12,;1.93,-.12,;-.51,1.13,;-.04,2.59,;1.47,2.91,;-1.07,3.74,;-.59,5.2,;-1.62,6.35,;-3.13,6.03,;-3.61,4.56,;-2.58,3.42,;-4.16,7.17,;-5.67,6.85,;-6.96,7.69,;-7.8,6.4,;-6.51,5.56,;-1.98,.65,;-3.31,1.42,;-4.65,.65,;-4.65,-.89,;-3.31,-1.66,;-1.98,-.89,)|
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Compound potencies were assessed through incorporation of 3H-SAM into a biotinylated H3 peptide. Specifically, 30 pM PRC2 containing wt EZH2 (pentame...

Citation and Details

BindingDB Entry DOI: 10.7270/Q20Z76H4
More data for this
Ligand-Target Pair