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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Histone-lysine N-methyltransferase SMYD3 | ||
| Ligand | BDBM433067 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | SMYD3 Biochemical Assay | ||
| IC50 | 0.940±n/a nM | ||
| Citation |  Mitchell, LH; Bell, AS; Chesworth, R; Foley, MA; Kuntz, KW; Mills, JE; Munchhof, MJ Substituted piperidine compounds US Patent US10577363 Publication Date 3/3/2020 | ||
| 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: |
| ||
| BDBM433067 | |||
| n/a | |||
| Name | BDBM433067 | ||
| Synonyms: | 5-cyclopropyl-N-((1R,3R,5S)-8-(((1s,4S)- 4-(dimethylamino)cyclohexyl)sulfonyl)-8- azabicyclo[3.2.1]octan-3-yl)isoxazole-3- carboxamide | US10577363, Compound 771 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H34N4O4S | ||
| Mol. Mass. | 450.595 | ||
| SMILES | CN(C)[C@H]1CC[C@H](CC1)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@@H](C2)NC(=O)c1cc(on1)C1CC1 |r,wU:6.9,16.17,13.13,3.2,wD:18.22,TLB:9:12:15.14:19.18.17,(-10.35,-1.77,;-9.58,-.43,;-10.35,.9,;-8.04,-.43,;-7.27,.9,;-5.73,.9,;-4.96,-.43,;-5.73,-1.77,;-7.27,-1.77,;-3.42,-.43,;-3.42,1.11,;-3.42,-1.97,;-1.77,-.43,;-.91,-2.2,;-2.12,-1.24,;-2.12,.3,;-.91,1.26,;.59,.92,;1.26,-.47,;.59,-1.86,;2.8,-.47,;3.57,.87,;2.8,2.2,;5.11,.87,;6.01,-.38,;7.48,.1,;7.48,1.64,;6.01,2.11,;8.81,-.67,;9.58,-2.01,;10.35,-.67,)| | ||
| Structure | 
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