Reaction Details |
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Target | Catechol O-methyltransferase |
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Ligand | BDBM50086230 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1477936 (CHEMBL3429503) |
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IC50 | 3400±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 | COMT_HUMAN | Catechol O-methyltransferase | Catechol O-methyltransferase (MB-COMT) |
Type: | Enzyme |
Mol. Mass.: | 30030.67 |
Organism: | Homo sapiens (Human) |
Description: | P21964 |
Residue: | 271 |
Sequence: | MPEAPPLLLAAVLLGLVLLVVLLLLLRHWGWGLCLIGWNEFILQPIHNLLMGDTKEQRIL
NHVLQHAEPGNAQSVLEAIDTYCEQKEWAMNVGDKKGKIVDAVIQEHQPSVLLELGAYCG
YSAVRMARLLSPGARLITIEINPDCAAITQRMVDFAGVKDKVTLVVGASQDIIPQLKKKY
DVDTLDMVFLDHWKDRYLPDTLLLEECGLLRKGTVLLADNVICPGAPDFLAHVRGSSCFE
CTHYQSFLEYREVVDGLEKAIYKGPGSEAGP
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BDBM50086230 |
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n/a |
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Name | BDBM50086230 |
Synonyms: | CHEMBL3425725 |
Type | Small organic molecule |
Emp. Form. | C12H11NO3 |
Mol. Mass. | 217.2206 |
SMILES | OCc1cc(=O)c(O)cn1-c1ccccc1 |
Structure |
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