Reaction Details  Report a problem with these data
Target
Nicotinamide N-methyltransferase
Ligand
BDBM50455095
Substrate
n/a
Meas. Tech.
ChEMBL_2262932 (CHEMBL5217943)
IC50
1388±n/a nM
Citation
 Barrows, RD; Jeffries, DE; Vishe, M; Tukachinsky, H; Zheng, SL; Li, F; Ma, Z; Li, X; Jin, S; Song, H; Zhang, R; Zhang, S; Ni, J; Luan, H; Wen, L; Rongshan, Y; Ying, C; Shair, MD Potent Uncompetitive Inhibitors of Nicotinamide  J Med Chem 65:14642-14654 (2022) [PubMed]  Article
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:
BDBM50455095
Synonyms:
CHEMBL4206972
Type:
Small organic molecule
Emp. Form.:
C7H8N2O2
Mol. Mass.:
152.1506
SMILES:
COc1ccc(cn1)C(N)=O
Structure:
Search PDB for entries with ligand similarity: