Reaction Details |
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Target | Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial |
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Ligand | BDBM50535658 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1931011 (CHEMBL4434262) |
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IC50 | 1900±n/a nM |
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Citation | Kawai, J; Ota, M; Ohki, H; Toki, T; Suzuki, M; Shimada, T; Matsui, S; Inoue, H; Sugihara, C; Matsuhashi, N; Matsui, Y; Takaishi, S; Nakayama, K Structure-Based Design and Synthesis of an Isozyme-Selective MTHFD2 Inhibitor with a Tricyclic Coumarin Scaffold. ACS Med Chem Lett10:893-898 (2019) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial |
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Name: | Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial |
Synonyms: | Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial | MTDC_HUMAN | MTHFD2 | Methenyltetrahydrofolate cyclohydrolase | NAD-dependent methylenetetrahydrofolate dehydrogenase | NMDMC |
Type: | PROTEIN |
Mol. Mass.: | 37904.22 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_109900 |
Residue: | 350 |
Sequence: | MAATSLMSALAARLLQPAHSCSLRLRPFHLAAVRNEAVVISGRKLAQQIKQEVRQEVEEW
VASGNKRPHLSVILVGENPASHSYVLNKTRAAAVVGINSETIMKPASISEEELLNLINKL
NNDDNVDGLLVQLPLPEHIDERRICNAVSPDKDVDGFHVINVGRMCLDQYSMLPATPWGV
WEIIKRTGIPTLGKNVVVAGRSKNVGMPIAMLLHTDGAHERPGGDATVTISHRYTPKEQL
KKHTILADIVISAAGIPNLITADMIKEGAAVIDVGINRVHDPVTAKPKLVGDVDFEGVRQ
KAGYITPVPGGVGPMTVAMLMKNTIIAAKKVLRLEEREVLKSKELGVATN
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BDBM50535658 |
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n/a |
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Name | BDBM50535658 |
Synonyms: | CHEMBL4465667 |
Type | Small organic molecule |
Emp. Form. | C18H19N3O4 |
Mol. Mass. | 341.3612 |
SMILES | OC(=O)c1ccc(cc1)C(=O)N1CCc2c(C1)c(=O)n1CCCCn21 |
Structure |
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