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SMILES: NC[C@@H](O)CC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(on1)C1CC1

InChI Key: InChIKey=LBNSICCETPGJNL-AVGNSLFASA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 293367   
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 SMYD3


(Homo sapiens (Human))		BDBM293367
PNG
(N-((1S,4r)-4-((S)- 4-amino-3-hydroxy- butanamido) ...)
Show SMILES NC[C@@H](O)CC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(on1)C1CC1 |r,wU:8.7,wD:11.14,2.2,(10.07,-1.5,;8.73,-2.27,;7.4,-1.5,;7.4,.04,;6.07,-2.27,;4.73,-1.5,;4.73,.04,;3.4,-2.27,;2.07,-1.5,;.73,-2.27,;-.6,-1.5,;-.6,.04,;.73,.81,;2.07,.04,;-1.93,.81,;-3.27,.04,;-3.27,-1.5,;-4.6,.81,;-5.85,-.1,;-7.09,.81,;-6.62,2.27,;-5.08,2.27,;-8.58,.41,;-10.07,.81,;-9.67,-.68,)|
Show InChI InChI=1S/C17H26N4O4/c18-9-13(22)7-16(23)19-11-3-5-12(6-4-11)20-17(24)14-8-15(25-21-14)10-1-2-10/h8,10-13,22H,1-7,9,18H2,(H,19,23)(H,20,24)/t11-,12-,13-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.08E+3n/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