Reaction Details Report a problem with these data
Target
Histone-lysine N-methyltransferase SMYD3
Ligand
BDBM293335
Substrate
n/a
Meas. Tech.
SMYD3 Biochemical Assay
IC50
475±n/a nM
Citation
 Foley, MA; Kuntz, KW; Mitchell, LH; Munchhof, 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:
BDBM293335
Synonyms:
N-((1r,4r)-4-(3- aminopropanamido) cyclohexyl)-5- cyclopropylisoxazole- 3-carboxamide | US10106510, Compound 4
Type:
Small organic molecule
Emp. Form.:
C16H24N4O3
Mol. Mass.:
320.3868
SMILES:
NCCC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(on1)C1CC1 |r,wU:6.5,wD:9.12,(-9.4,-2.27,;-8.07,-1.5,;-6.73,-2.27,;-5.4,-1.5,;-5.4,.04,;-4.07,-2.27,;-2.73,-1.5,;-2.73,.04,;-1.4,.81,;-.07,.04,;-.07,-1.5,;-1.4,-2.27,;1.27,.81,;2.6,.04,;2.6,-1.5,;3.93,.81,;5.18,-.1,;6.43,.81,;5.95,2.27,;4.41,2.27,;7.91,.41,;9,-.68,;9.4,.81,)|
Structure:
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