| Reaction Details |
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 | Report a problem with these data |
| Target | Menin |
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| Ligand | BDBM506337 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Menin Binding Affinity |
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| IC50 | 2.00±n/a nM |
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| Citation |  Wang, S; Aguilar, A; Xu, S; Huang, L; Stuckey, J; Xu, T Piperidines as covalent menin inhibitors US Patent US11045448 Publication Date 6/29/2021 |
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| More Info.: | Get all data from this article, Assay Method |
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| Menin |
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| Name: | Menin |
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| Synonyms: | MEN1 | MEN1_HUMAN | Menin/Histone-lysine N-methyltransferase MLL | SCG2 |
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| Type: | Protein |
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| Mol. Mass.: | 68022.55 |
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| Organism: | Homo sapiens (Human) |
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| Description: | O00255 |
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| Residue: | 610 |
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| Sequence: | MGLKAAQKTLFPLRSIDDVVRLFAAELGREEPDLVLLSLVLGFVEHFLAVNRVIPTNVPE
LTFQPSPAPDPPGGLTYFPVADLSIIAALYARFTAQIRGAVDLSLYPREGGVSSRELVKK
VSDVIWNSLSRSYFKDRAHIQSLFSFITGTKLDSSGVAFAVVGACQALGLRDVHLALSED
HAWVVFGPNGEQTAEVTWHGKGNEDRRGQTVNAGVAERSWLYLKGSYMRCDRKMEVAFMV
CAINPSIDLHTDSLELLQLQQKLLWLLYDLGHLERYPMALGNLADLEELEPTPGRPDPLT
LYHKGIASAKTYYRDEHIYPYMYLAGYHCRNRNVREALQAWADTATVIQDYNYCREDEEI
YKEFFEVANDVIPNLLKEAASLLEAGEERPGEQSQGTQSQGSALQDPECFAHLLRFYDGI
CKWEEGSPTPVLHVGWATFLVQSLGRFEGQVRQKVRIVSREAEAAEAEEPWGEEAREGRR
RGPRRESKPEEPPPPKKPALDKGLGTGQGAVSGPPRKPPGTVAGTARGPEGGSTAQVPAP
TASPPPEGPVLTFQSEKMKGMKELLVATKINSSAIKLQLTAQSQVQMKKQKVSTPSDYTL
SFLKRQRKGL
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| BDBM506337 |
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| n/a |
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| Name | BDBM506337 |
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| Synonyms: | US11045448, Cpd. No. 5 | methyl ((1S,2R)-2-((S)-(1-((1-(4-((3- acrylamidophenyl)sulfonyl)phenyl)azetidin-3- yl)methyl)piperidin-4-yl)(cyano)(3- fluorophenyl)methyl)cyclopentyl)carbamate |
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| Type | Small organic molecule |
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| Emp. Form. | C39H44FN5O5S |
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| Mol. Mass. | 713.861 |
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| SMILES | COC(=O)N[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)C=C)c2)CC1)c1cccc(F)c1 |r| |
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| Structure | 
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