Reaction Details Report a problem with these data
Target
Phenylethanolamine N-methyltransferase
Ligand
BDBM50080520
Substrate
n/a
Meas. Tech.
ChEMBL_152390 (CHEMBL765513)
Ki
210±n/a nM
Citation
 Grunewald, GL; Caldwell, TM; Li, Q; Slavica, M; Criscione, KR; Borchardt, RT; Wang, W Synthesis and biochemical evaluation of 3-fluoromethyl-1,2,3, 4-tetrahydroisoquinolines as selective inhibitors of phenylethanolamine N-methyltransferase versus the alpha(2)-adrenoceptor. J Med Chem 42:3588-601 (1999) [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:
BDBM50080520
Synonyms:
3-Fluoromethyl-7-iodo-1,2,3,4-tetrahydro-isoquinoline | CHEMBL275595
Type:
Small organic molecule
Emp. Form.:
C10H11FIN
Mol. Mass.:
291.1039
SMILES:
FCC1Cc2ccc(I)cc2CN1
Structure:
Search PDB for entries with ligand similarity: