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TargetCatechol O-methyltransferase
LigandBDBM50086211
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1477937 (CHEMBL3429504)
IC50 57.0±n/a nM
Citation Harrison, STPoslusney, MSMulhearn, JJZhao, ZKett, NRSchubert, JWMelamed, JYAllison, TJPatel, SBSanders, JMSharma, SSmith, RFHall, DLRobinson, RGSachs, NAHutson, PHWolkenberg, SEBarrow, JC Synthesis and Evaluation of Heterocyclic Catechol Mimics as Inhibitors of Catechol-O-methyltransferase (COMT). ACS Med Chem Lett6:318-23 (2015) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Catechol O-methyltransferase
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:
MPLAAVSLGLLLLALLLLLRHLGWGLVTIFWFEYVLQPVHNLIMGDTKEQRILRYVQQNA
KPGDPQSVLEAIDTYCTQKEWAMNVGDAKGQIMDAVIREYSPSLVLELGAYCGYSAVRMA
RLLQPGARLLTMEMNPDYAAITQQMLNFAGLQDKVTILNGASQDLIPQLKKKYDVDTLDM
VFLDHWKDRYLPDTLLLEKCGLLRKGTVLLADNVIVPGTPDFLAYVRGSSSFECTHYSSY
LEYMKVVDGLEKAIYQGPSSPDKS
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  Blast E-value cutoff:
BDBM50086211
n/a
NameBDBM50086211
Synonyms:CHEMBL3425738
TypeSmall organic molecule
Emp. Form.C19H17NO3
Mol. Mass.307.3432
SMILESCC(O)c1cc(=O)c(O)cn1-c1cccc(c1)-c1ccccc1
Structure
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