Reaction Details |
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Target | Phenylethanolamine N-methyltransferase |
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Ligand | BDBM50151343 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_303718 (CHEMBL829053) |
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Ki | 1200±n/a nM |
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Citation | Romero, FA; Vodonick, SM; Criscione, KR; McLeish, MJ; Grunewald, GL Inhibitors of phenylethanolamine N-methyltransferase that are predicted to penetrate the blood-brain barrier: design, synthesis, and evaluation of 3-fluoromethyl-7-(N-substituted aminosulfonyl)-1,2,3,4-tetrahydroisoquinolines that possess low affinity toward the alpha2-adrenoceptor. J Med Chem47:4483-93 (2004) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Phenylethanolamine N-methyltransferase |
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Name: | Phenylethanolamine N-methyltransferase |
Synonyms: | Noradrenaline N-methyltransferase | PENT | PNMT | PNMT_HUMAN | PNMTase | Phenylethanolamine N-Methyltransferase (PNMT) |
Type: | Enzyme |
Mol. Mass.: | 30852.66 |
Organism: | Homo sapiens (Human) |
Description: | n/a |
Residue: | 282 |
Sequence: | MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRC
LAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGA
FNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVS
AFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVR
EALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL
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BDBM50151343 |
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n/a |
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Name | BDBM50151343 |
Synonyms: | (+)-3-(fluoromethyl)-7-(thiomorpholinosulfonyl)-1,2,3,4-tetrahydroisoquinoline | 3-Fluoromethyl-7-(thiomorpholine-4-sulfonyl)-1,2,3,4-tetrahydro-isoquinoline | CHEMBL355581 |
Type | Small organic molecule |
Emp. Form. | C14H19FN2O2S2 |
Mol. Mass. | 330.441 |
SMILES | FCC1Cc2ccc(cc2CN1)S(=O)(=O)N1CCSCC1 |
Structure |
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