Reaction Details |
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Target | Catechol O-methyltransferase |
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Ligand | BDBM50017852 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_47065 |
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IC50 | 12±n/a nM |
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Citation | Bäckström, R; Honkanen, E; Pippuri, A; Kairisalo, P; Pystynen, J; Heinola, K; Nissinen, E; Linden, IB; Männistö, PT; Kaakkola, S Synthesis of some novel potent and selective catechol O-methyltransferase inhibitors. J Med Chem32:841-6 (1989) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Catechol O-methyltransferase |
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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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BDBM50017852 |
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n/a |
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Name | BDBM50017852 |
Synonyms: | 4-(3,4-Dihydroxy-5-nitro-phenyl)-3-methyl-but-3-en-2-one | CHEMBL167054 |
Type | Small organic molecule |
Emp. Form. | C11H11NO5 |
Mol. Mass. | 237.2087 |
SMILES | CC(=O)C(C)=Cc1cc(O)c(O)c(c1)[N+]([O-])=O |w:5.5| |
Structure |
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