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Target
Nicotinamide N-methyltransferase
Ligand
BDBM50598891
Substrate
n/a
Meas. Tech.
ChEMBL_2228242 (CHEMBL5141755)
IC50
390±n/a nM
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 Chem 65:10655-10673 (2022) [PubMed] 
Target
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:
MESGFTSKDTYLSHFNPRDYLEKYYKFGSRHSAESQILKHLLKNLFKIFCLDGVKGDLLIDIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWLKKEPEAFDWSPVVTYVCDLEGNRVKGPEKEEKLRQAVKQVLKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCRALRNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGREAVEAAVKEAGYTIEWFEVISQSYSSTMANNEGLFSLVARKLSRPL
  
Inhibitor
Name:
BDBM50598891
Synonyms:
CHEMBL5200510
Type:
Small organic molecule
Emp. Form.:
C31H29ClN8O
Mol. Mass.:
565.068
SMILES:
Cc1ccc2n(Cc3ccc(Cl)cc3)c(nc2c1)[C@H]1C[C@@H](CN1C(=O)c1cnc2[nH]ccc2c1)n1ccnc1CN |r|
Structure:
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