Reaction Details Report a problem with these data
Target
Phenylethanolamine N-methyltransferase
Ligand
BDBM50028832
Substrate
n/a
Meas. Tech.
ChEBML_152416
IC50
1000000±n/a nM
Citation
 Vincek, WC; Aldrich, CS; Borchardt, RT; Grunewald, GL Importance of the aromatic ring in adrenergic amines. 5. Nonaromatic analogues of phenylethanolamine as inhibitors of phenylethanolamine N-methyltransferase: role of hydrophobic and steric interactions. J Med Chem 24:7-12 (1981) [PubMed]  Article 
Target
Name:
Phenylethanolamine N-methyltransferase
Synonyms:
Noradrenaline N-methyltransferase | PNMT | PNMT_BOVIN | PNMTase
Type:
Enzyme
Mol. Mass.:
30916.97
Organism:
Bos taurus (bovine)
Description:
n/a
Residue:
283
Sequence:
MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV
  
Inhibitor
Name:
BDBM50028832
Synonyms:
3-methylbutanal | 3-methylbutyraldehyde | CHEMBL18360 | Isoamyl aldehyde | Isopentaldehyde | Isovaleral | Isovalerylaldehyde | beta-Methylbutanal | iso-C4H9CHO
Type:
Small organic molecule
Emp. Form.:
C5H10O
Mol. Mass.:
86.1323
SMILES:
CC(C)CC=O
Structure:
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