Target
Catechol O-methyltransferase
Ligand
BDBM50004043
Substrate
n/a
Meas. Tech.
ChEBML_47065
IC50
24±n/a nM
Citation
 Bäckström, RHonkanen, EPippuri, AKairisalo, PPystynen, JHeinola, KNissinen, ELinden, IBMännistö, PTKaakkola, S Synthesis of some novel potent and selective catechol O-methyltransferase inhibitors. J Med Chem 32:841-6 (1989) [PubMed]  Article 
Target
Name:
Catechol O-methyltransferase
Synonyms:
COMT_RAT | Catechol O-methyltransferase | Catechol-O-methyltransferase | Comt
Type:
Enzyme
Mol. Mass.:
29594.09
Organism:
Rattus norvegicus (Rat)
Description:
n/a
Residue:
264
Sequence:
MPLAAVSLGLLLLALLLLLRHLGWGLVTIFWFEYVLQPVHNLIMGDTKEQRILRYVQQNAKPGDPQSVLEAIDTYCTQKEWAMNVGDAKGQIMDAVIREYSPSLVLELGAYCGYSAVRMARLLQPGARLLTMEMNPDYAAITQQMLNFAGLQDKVTILNGASQDLIPQLKKKYDVDTLDMVFLDHWKDRYLPDTLLLEKCGLLRKGTVLLADNVIVPGTPDFLAYVRGSSSFECTHYSSYLEYMKVVDGLEKAIYQGPSSPDKS
  
Inhibitor
Name:
BDBM50004043
Synonyms:
3,4-Dihydroxy-5-Nitrobenzaldehyde (Rat) | 3,4-Dihydroxy-5-nitro-benzaldehyde | CHEMBL1244
Type:
Small organic molecule
Emp. Form.:
C7H5NO5
Mol. Mass.:
183.1183
SMILES:
Oc1cc(C=O)cc(c1O)[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: