Reaction Details Report a problem with these data
Target
Histone-lysine N-methyltransferase SMYD3
Ligand
BDBM293363
Substrate
n/a
Meas. Tech.
SMYD3 Biochemical Assay
IC50
567±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
More Info.:
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:
BDBM293363
Synonyms:
N-((1r,4r)-4-(3-amino-2- hydroxypropanamido) cyclohexyl)-5- cyclopropylisoxazole- 3-carboxamide | US10106510, Compound 27
Type:
Small organic molecule
Emp. Form.:
C16H24N4O4
Mol. Mass.:
336.3862
SMILES:
NCC(O)C(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(on1)C1CC1 |r,wU:7.6,wD:10.13,(9.4,1.5,;8.07,.73,;6.73,1.5,;6.73,3.04,;5.4,.73,;5.4,-.81,;4.07,1.5,;2.73,.73,;2.73,-.81,;1.4,-1.58,;.07,-.81,;.07,.73,;1.4,1.5,;-1.27,-1.58,;-2.6,-.81,;-2.6,.73,;-3.93,-1.58,;-5.18,-.67,;-6.43,-1.58,;-5.95,-3.04,;-4.41,-3.04,;-7.91,-1.18,;-9,-.09,;-9.4,-1.58,)|