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SMILES: CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)NC(C)(C)C)c2ccccc12

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 574841   
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))		BDBM574841
PNG
(US11459315, Example 5 (isomer 2))
Show SMILES CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)NC(C)(C)C)c2ccccc12 |r,wU:20.26,wD:18.19,(-4.64,-1.85,;-4.64,-.31,;-6,.52,;-7.21,-.2,;-8.68,.52,;-9.96,-.2,;-8.69,2.02,;-7.36,2.8,;-7.36,4.34,;-5.97,2.12,;-4.68,2.84,;-3.36,2.02,;-2.04,2.8,;-2.04,4.34,;-.65,2.12,;.67,2.69,;1.03,4.27,;1.75,1.52,;3.28,1.73,;3.89,3.12,;4.18,.48,;5.71,.59,;6.61,-.59,;5.96,-2.02,;4.46,-2.16,;3.57,-.98,;6.89,-3.34,;8.43,-3.13,;9.43,-4.34,;8.89,-1.63,;9.96,-2.84,;.96,.19,;1.46,-1.27,;.46,-2.38,;-1.04,-2.06,;-1.5,-.63,;-.5,.52,)|
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