Target
Histone-lysine N-methyltransferase SMYD3
Ligand
BDBM293394
Substrate
n/a
Meas. Tech.
SMYD3 Biochemical Assay
IC50
6110±n/a nM
Citation
 Foley, MAKuntz, KWMitchell, LHMunchhof, MJ Substituted isoxazoles for treating cancer US Patent  US10106510 Publication Date 10/23/2018 
Target
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:
MEPLKVEKFATAKRGNGLRAVTPLRPGELLFRSDPLAYTVCKGSRGVVCDRCLLGKEKLMRCSQCRVAKYCSAKCQKKAWPDHKRECKCLKSCKPRYPPDSVRLLGRVVFKLMDGAPSESEKLYSFYDLESNINKLTEDKKEGLRQLVMTFQHFMREEIQDASQLPPAFDLFEAFAKVICNSFTICNAEMQEVGVGLYPSISLLNHSCDPNCSIVFNGPHLLLRAVRDIEVGEELTICYLDMLMTSEERRKQLRDQYCFECDCFRCQTQDKDADMLTGDEQVWKEVQESLKKIEELKAHWKWEQVLAMCQAIISSNSERLPDINIYQLKVLDCAMDACINLGLLEEALFYGTRTMEPYRIFFPGSHPVRGVQVMKVGKLQLHQGMFPQAMKNLRLAFDIMRVTHGREHSLIEDLILLLEECDANIRAS
  
Inhibitor
Name:
BDBM293394
Synonyms:
N-((1S,4r)-4-((S)-3- aminobutanamido) cyclohexyl)-5- cyclopropyl-N- methylisoxazole-3- carboxamide | US10106510, Compound 58
Type:
Small organic molecule
Emp. Form.:
C18H28N4O3
Mol. Mass.:
348.4399
SMILES:
C[C@H](N)CC(=O)N[C@H]1CC[C@@H](CC1)N(C)C(=O)c1cc(on1)C1CC1 |r,wU:7.6,wD:10.13,1.1,(-9.4,-2.31,;-8.07,-1.54,;-8.07,,;-6.73,-2.31,;-5.4,-1.54,;-5.4,,;-4.07,-2.31,;-2.73,-1.54,;-2.73,,;-1.4,.77,;-.07,,;-.07,-1.54,;-1.4,-2.31,;1.27,.77,;1.27,2.31,;2.6,,;2.6,-1.54,;3.93,.77,;5.18,-.14,;6.43,.77,;5.95,2.23,;4.41,2.23,;7.91,.37,;9,-.72,;9.4,.77,)|
Structure:
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