Reaction Details |
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Target | Nicotinamide N-methyltransferase |
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Ligand | BDBM50598878 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2228242 (CHEMBL5141755) |
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IC50 | 100±n/a nM |
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Citation | Yoshida, S; Uehara, S; Kondo, N; Takahashi, Y; Yamamoto, S; Kameda, A; Kawagoe, S; Inoue, N; Yamada, M; Yoshimura, N; Tachibana, Y Peptide-to-Small Molecule: A Pharmacophore-Guided Small Molecule Lead Generation Strategy from High-Affinity Macrocyclic Peptides. J Med Chem65:10655-10673 (2022) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Nicotinamide N-methyltransferase |
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Name: | Nicotinamide N-methyltransferase |
Synonyms: | NNMT | NNMT_HUMAN | Nicotinamide N-methyltransferase | Nicotinamide N-methyltransferase (NNMT) |
Type: | Protein |
Mol. Mass.: | 29571.16 |
Organism: | Homo sapiens (Human) |
Description: | n/a |
Residue: | 264 |
Sequence: | MESGFTSKDTYLSHFNPRDYLEKYYKFGSRHSAESQILKHLLKNLFKIFCLDGVKGDLLI
DIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWLKKEPEAFDWSPVVTYVCDLEGN
RVKGPEKEEKLRQAVKQVLKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCRAL
RNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGREAVEAAVKEAGYTIEWFEVISQ
SYSSTMANNEGLFSLVARKLSRPL
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BDBM50598878 |
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n/a |
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Name | BDBM50598878 |
Synonyms: | CHEMBL5174146 |
Type | Small organic molecule |
Emp. Form. | C58H77N15O11S |
Mol. Mass. | 1192.391 |
SMILES | [H][C@@]12CCCN1C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)CN(CCCCCC)C(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(cc1)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CSC[C@H](NC2=O)C(=O)NCC(N)=O |r| |
Structure |
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