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SMILES: FC(F)(F)c1ccc(Cn2cc(CN3CC(C3)NC(=O)c3cn(nn3)C3CC3)cn2)cc1

InChI Key: InChIKey=QSFSRTSDIDQFDW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 378760   
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
N-lysine methyltransferase SMYD2


(Homo sapiens (Human))		BDBM378760
PNG
(1-cyclopropyl-N-(1-((1-(4-(trifluoromethyl)benzyl)...)
Show SMILES FC(F)(F)c1ccc(Cn2cc(CN3CC(C3)NC(=O)c3cn(nn3)C3CC3)cn2)cc1
Show InChI InChI=1S/C21H22F3N7O/c22-21(23,24)16-3-1-14(2-4-16)9-30-10-15(7-25-30)8-29-11-17(12-29)26-20(32)19-13-31(28-27-19)18-5-6-18/h1-4,7,10,13,17-18H,5-6,8-9,11-12H2,(H,26,32)
PDB

UniProtKB/SwissProt

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n/an/a 14n/an/an/an/an/an/a



ENSCMu



Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% Bovine Skin Gelatin, and 0.002% Tween20, prepared on...

Bioorg Med Chem 14: 7241-57 (2006)


BindingDB Entry DOI: 10.7270/Q2DJ5HX2
More data for this
Ligand-Target Pair