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TargetHistone-lysine N-methyltransferase SMYD3
LigandBDBM50500876
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1576442 (CHEMBL3803119)
IC50 5.0±n/a nM
Citation Mitchell, LHBoriack-Sjodin, PASmith, SThomenius, MRioux, NMunchhof, MMills, JEKlaus, CTotman, JRiera, TVRaimondi, AJacques, SLWest, KFoley, MWaters, NJKuntz, KWWigle, TJScott, MPCopeland, RASmith, JJChesworth, R Novel Oxindole Sulfonamides and Sulfamides: EPZ031686, the First Orally Bioavailable Small Molecule SMYD3 Inhibitor. ACS Med Chem Lett7:134-8 (2016) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Histone-lysine N-methyltransferase SMYD3
Name:Histone-lysine N-methyltransferase SMYD3
Synonyms:SET and MYND domain-containing protein 3 | SMYD3 | SMYD3_HUMAN | ZMYND1 | ZNFN3A1 | Zinc finger MYND domain-containing protein 1
Type:Enzyme
Mol. Mass.:49101.22
Organism:Homo sapiens (Human)
Description:Q9H7B4-2
Residue:428
Sequence:
MEPLKVEKFATAKRGNGLRAVTPLRPGELLFRSDPLAYTVCKGSRGVVCDRCLLGKEKLM
RCSQCRVAKYCSAKCQKKAWPDHKRECKCLKSCKPRYPPDSVRLLGRVVFKLMDGAPSES
EKLYSFYDLESNINKLTEDKKEGLRQLVMTFQHFMREEIQDASQLPPAFDLFEAFAKVIC
NSFTICNAEMQEVGVGLYPSISLLNHSCDPNCSIVFNGPHLLLRAVRDIEVGEELTICYL
DMLMTSEERRKQLRDQYCFECDCFRCQTQDKDADMLTGDEQVWKEVQESLKKIEELKAHW
KWEQVLAMCQAIISSNSERLPDINIYQLKVLDCAMDACINLGLLEEALFYGTRTMEPYRI
FFPGSHPVRGVQVMKVGKLQLHQGMFPQAMKNLRLAFDIMRVTHGREHSLIEDLILLLEE
CDANIRAS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50500876
n/a
NameBDBM50500876
Synonyms:CHEMBL3797575
TypeSmall organic molecule
Emp. Form.C22H29ClN4O4S
Mol. Mass.481.008
SMILES[H][C@]12CC[C@]([H])(C[C@@H](C1)NC(=O)c1cc3CC(=O)Nc3cc1Cl)N2S(=O)(=O)C[C@@H]1CCCNC1 |r|
Structure
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