Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase SMYD3' and Ligand = 'BDBM293349'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Histone-lysine N-methyltransferase SMYD3 (Homo sapiens (Human))	BDBM293349 (N-((1R,4r)-4-((1r,4R)-4- aminocyclohexane-1- carbo...) Show SMILES N[C@H]1CC[C@@H](CC1)C(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(on1)C1CC1 |r,wU:10.10,1.0,wD:4.7,13.17,(-10.07,-3.43,;-8.73,-2.66,;-8.73,-1.12,;-7.4,-.35,;-6.07,-1.12,;-6.07,-2.66,;-7.4,-3.43,;-4.73,-.35,;-4.73,1.19,;-3.4,-1.12,;-2.07,-.35,;-2.07,1.19,;-.73,1.96,;.6,1.19,;.6,-.35,;-.73,-1.12,;1.93,1.96,;3.27,1.19,;3.27,-.35,;4.6,1.96,;5.85,1.06,;7.09,1.96,;6.62,3.43,;5.08,3.43,;8.58,1.56,;9.67,.48,;10.07,1.96,)| Show InChI InChI=1S/C20H30N4O3/c21-14-5-3-13(4-6-14)19(25)22-15-7-9-16(10-8-15)23-20(26)17-11-18(27-24-17)12-1-2-12/h11-16H,1-10,21H2,(H,22,25)(H,23,26)/t13-,14-,15-,16-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	606	n/a	n/a	n/a	n/a	n/a	n/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