Reaction Details |
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Target | Phenylethanolamine N-methyltransferase |
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Ligand | BDBM50554689 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2050315 (CHEMBL4705014) |
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Ki | 3.9±n/a nM |
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Citation | Lu, J; Bart, AG; Wu, Q; Criscione, KR; McLeish, MJ; Scott, EE; Grunewald, GL Structure-Based Drug Design of Bisubstrate Inhibitors of Phenylethanolamine J Med Chem63:13878-13898 (2020) [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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BDBM50554689 |
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n/a |
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Name | BDBM50554689 |
Synonyms: | CHEMBL4754656 |
Type | Small organic molecule |
Emp. Form. | C24H33N7O3S |
Mol. Mass. | 499.629 |
SMILES | Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CSCCCCNCC2Cc3ccccc3CN2)[C@@H](O)[C@H]1O |r| |
Structure |
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