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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase SMYD3' and Ligand = 'BDBM293388'   
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 SMYD3


(Homo sapiens (Human))		BDBM293388
PNG
(N-((1r,4r)-4-(3- aminopropanamido) cyclohexyl)-5- ...)
Show SMILES NCCC(=O)N[C@H]1CC[C@@H](CC1)N(CCO)C(=O)c1cc(on1)C1CC1 |r,wU:6.5,wD:9.12,(-8.73,-3.43,;-7.4,-2.66,;-6.07,-3.43,;-4.73,-2.66,;-4.73,-1.12,;-3.4,-3.43,;-2.07,-2.66,;-2.07,-1.12,;-.73,-.35,;.6,-1.12,;.6,-2.66,;-.73,-3.43,;1.93,-.35,;3.27,-1.12,;3.27,-2.66,;4.6,-3.43,;1.93,1.19,;.6,1.96,;3.27,1.96,;4.51,1.06,;5.76,1.96,;5.28,3.43,;3.74,3.43,;7.25,1.56,;8.34,.48,;8.73,1.96,)|
Show InChI InChI=1S/C18H28N4O4/c19-8-7-17(24)20-13-3-5-14(6-4-13)22(9-10-23)18(25)15-11-16(26-21-15)12-1-2-12/h11-14,23H,1-10,19H2,(H,20,24)/t13-,14-
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.68E+4n/an/an/an/an/an/a



EPIZYME, INC.

US Patent


Assay Description
S-adenosylmethionine (SAM), S-adenosylhomocysteine (SAH), Tris, Tween20, dimethylsulfoxide (DMSO), bovine skin gelatin (BSG), and Tris(2-carboxyethyl...

US Patent US10106510 (2018)


BindingDB Entry DOI: 10.7270/Q22V2J5G
More data for this
Ligand-Target Pair