| Reaction Details |
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 | Report a problem with these data |
| Target | Pyridoxal kinase |
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| Ligand | BDBM50212216 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1636780 (CHEMBL3879678) |
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| IC50 | >10000±n/a nM |
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| Citation |  Won, SJ; Eschweiler, JD; Majmudar, JD; Chong, FS; Hwang, SY; Ruotolo, BT; Martin, BR Affinity-Based Selectivity Profiling of an In-Class Selective Competitive Inhibitor of Acyl Protein Thioesterase 2. ACS Med Chem Lett8:215-220 (2017) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Pyridoxal kinase |
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| Name: | Pyridoxal kinase |
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| Synonyms: | C21orf124 | C21orf97 | PDXK | PDXK_HUMAN | PKH | PNK | Pyridoxine kinase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 35099.40 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_103125 |
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| Residue: | 312 |
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| Sequence: | MEEECRVLSIQSHVIRGYVGNRAATFPLQVLGFEIDAVNSVQFSNHTGYAHWKGQVLNSD
ELQELYEGLRLNNMNKYDYVLTGYTRDKSFLAMVVDIVQELKQQNPRLVYVCDPVLGDKW
DGEGSMYVPEDLLPVYKEKVVPLADIITPNQFEAELLSGRKIHSQEEALRVMDMLHSMGP
DTVVITSSDLPSPQGSNYLIVLGSQRRRNPAGSVVMERIRMDIRKVDAVFVGTGDLFAAM
LLAWTHKHPNNLKVACEKTVSTLHHVLQRTIQCAKAQAGEGVRPSPMQLELRMVQSKRDI
EDPEIVVQATVL
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| BDBM50212216 |
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| n/a |
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| Name | BDBM50212216 |
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| Synonyms: | CHEMBL3944678 |
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| Type | Small organic molecule |
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| Emp. Form. | C43H54N8O9S3 |
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| Mol. Mass. | 923.132 |
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| SMILES | [H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCn3cc(COc4ccc(cc4)N4CCN(CC4)C(=O)c4cc5CS(=O)(=O)c6ccccc6-c5s4)nn3)[C@@]1([H])NC(=O)N2 |r| |
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| Structure | 
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