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SMILES: CCN(C(=O)C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(C#N)c(F)c1

InChI Key: InChIKey=XGIXJCTYYUZOHM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 441965   
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 [Y641F]


(Homo sapiens (Human))		BDBM441965
PNG
(US10647700, Compound 19)
Show SMILES CCN(C(=O)C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(C#N)c(F)c1
Show InChI InChI=1S/C31H33FN4O3/c1-5-36(31(39)21-8-6-7-9-21)28-15-24(22-10-11-23(16-33)27(32)14-22)13-25(20(28)4)29(37)34-17-26-18(2)12-19(3)35-30(26)38/h10-15,21H,5-9,17H2,1-4H3,(H,34,37)(H,35,38)
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PC cid
PC sid
UniChem
US Patent
n/an/a 220n/an/an/an/an/an/a



TARAPEUTICS SCIENCE INC.

US Patent


Assay Description
Enzymatic activity assay was conducted using EZH2(Y641F) TR-FRET assay KIT from Cisbio company on compounds that were shown to be active in primary s...

US Patent US10647700 (2020)

More data for this
Ligand-Target Pair