Reaction Details Report a problem with these data
Target
Phenylethanolamine N-methyltransferase
Ligand
BDBM50028811
Substrate
n/a
Meas. Tech.
ChEBML_152416
IC50
195000±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:
BDBM50028811
Synonyms:
Adamantan-1-yl-trimethylsilanyloxy-acetonitrile | CHEMBL429382
Type:
Small organic molecule
Emp. Form.:
C15H25NOSi
Mol. Mass.:
263.4506
SMILES:
C[Si](C)(C)OC(C#N)C12CC3CC(CC(C3)C1)C2 |TLB:15:10:17:16.14.13,15:14:17:9.10.11,THB:13:12:9:16.14.15,13:14:9:17.12.11|
Structure:
Search PDB for entries with ligand similarity: