Reaction Details |
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Target | Catechol O-methyltransferase |
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Ligand | BDBM50086213 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1477937 (CHEMBL3429504) |
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IC50 | 16±n/a nM |
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Citation | Harrison, ST; Poslusney, MS; Mulhearn, JJ; Zhao, Z; Kett, NR; Schubert, JW; Melamed, JY; Allison, TJ; Patel, SB; Sanders, JM; Sharma, S; Smith, RF; Hall, DL; Robinson, RG; Sachs, NA; Hutson, PH; Wolkenberg, SE; Barrow, JC Synthesis and Evaluation of Heterocyclic Catechol Mimics as Inhibitors of Catechol-O-methyltransferase (COMT). ACS Med Chem Lett6:318-23 (2015) [PubMed] Article |
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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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BDBM50086213 |
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n/a |
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Name | BDBM50086213 |
Synonyms: | CHEMBL3425734 |
Type | Small organic molecule |
Emp. Form. | C17H13NO2 |
Mol. Mass. | 263.2906 |
SMILES | Oc1cn(ccc1=O)-c1cccc(c1)-c1ccccc1 |
Structure |
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