Reaction Details |
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Target | Amine oxidase [flavin-containing] A |
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Ligand | BDBM15595 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_739780 (CHEMBL1763606) |
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Ki | 19998618.7±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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BDBM15595 |
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n/a |
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Name | BDBM15595 |
Synonyms: | (2-phenylethyl)(1H-pyrrol-2-ylmethyl)amine | N-(2-Phenylethyl),N-(pyrrol-2-ylmethyl)amine | pyrrole inhibitor 20 |
Type | Small organic molecule |
Emp. Form. | C13H16N2 |
Mol. Mass. | 200.2795 |
SMILES | C(Cc1ccccc1)NCc1ccc[nH]1 |
Structure |
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