Reaction Details |
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Target | Amine oxidase [flavin-containing] A |
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Ligand | BDBM50168984 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_739780 (CHEMBL1763606) |
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Ki | 9506047.94±n/a nM |
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Citation | Shelke, SM; Bhosale, SH; Dash, RC; Suryawanshi, MR; Mahadik, KR Exploration of new scaffolds as potential MAO-A inhibitors using pharmacophore and 3D-QSAR based in silico screening. Bioorg Med Chem Lett21:2419-24 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Amine oxidase [flavin-containing] A |
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Name: | Amine oxidase [flavin-containing] A |
Synonyms: | AOFA_HUMAN | Amine oxidase (flavin-containing) A | MAO-A | MAOA | Monoamine oxidase | Monoamine oxidase type A | Monoamine oxidase type A (MAO A) | Monoamine oxidase type A (MAO A) | Monoamine oxidase type A (MAOA) |
Type: | Protein |
Mol. Mass.: | 59689.53 |
Organism: | Homo sapiens (Human) |
Description: | P21397 |
Residue: | 527 |
Sequence: | MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGGRTYTIRNEHV
DYVDVGGAYVGPTQNRILRLSKELGIETYKVNVSERLVQYVKGKTYPFRGAFPPVWNPIA
YLDYNNLWRTIDNMGKEIPTDAPWEAQHADKWDKMTMKELIDKICWTKTARRFAYLFVNI
NVTSEPHEVSALWFLWYVKQCGGTTRIFSVTNGGQERKFVGGSGQVSERIMDLLGDQVKL
NHPVTHVDQSSDNIIIETLNHEHYECKYVINAIPPTLTAKIHFRPELPAERNQLIQRLPM
GAVIKCMMYYKEAFWKKKDYCGCMIIEDEDAPISITLDDTKPDGSLPAIMGFILARKADR
LAKLHKEIRKKKICELYAKVLGSQEALHPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYG
RVIRQPVGRIFFAGTETATKWSGYMEGAVEAGERAAREVLNGLGKVTEKDIWVQEPESKD
VPAVEITHTFWERNLPSVSGLLKIIGFSTSVTALGFVLYKYKLLPRS
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BDBM50168984 |
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n/a |
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Name | BDBM50168984 |
Synonyms: | 1-(1-Methyl-1H-pyrrol-2-yl)-2-phenyl-2-pyrrolidin-1-yl-ethanone (+)-S | CHEMBL191203 |
Type | Small organic molecule |
Emp. Form. | C17H20N2O |
Mol. Mass. | 268.3535 |
SMILES | Cn1cccc1C(=O)[C@@H](N1CCCC1)c1ccccc1 |
Structure |
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