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Target
Amine oxidase [flavin-containing] A
Ligand
BDBM50168975
Substrate
n/a
Meas. Tech.
ChEMBL_302385 (CHEMBL830352)
Ki
82.0±n/a nM
Citation
 Di Santo, R; Costi, R; Roux, A; Artico, M; Befani, O; Meninno, T; Agostinelli, E; Palmegiani, P; Turini, P; Cirilli, R; Ferretti, R; Gallinella, B; La Torre, F Design, synthesis, and biological activities of pyrrolylethanoneamine derivatives, a novel class of monoamine oxidases inhibitors. J Med Chem 48:4220-3 (2005) [PubMed]  Article 
Target
Name:
Amine oxidase [flavin-containing] A
Synonyms:
AOFA_RAT | Amine oxidase (flavin-containing) A | Amine oxidase [flavin-containing] A | Maoa | Monoamine Oxidase Type A (MAO-A) | Monoamine oxidase | Monoamine oxidase A (MAO-A) | Monoamine oxidase A (rMAO-A) | Monoamine oxidase type A (MAOA)
Type:
Enzyme
Mol. Mass.:
59515.21
Organism:
Rattus norvegicus (rat)
Description:
n/a
Residue:
526
Sequence:
MTDLEKPNLAGHMFDVGLIGGGISGLAAAKLLSEYKINVLVLEARDRVGGRTYTVRNEHVKWVDVGGAYVGPTQNRILRLSKELGIETYKVNVNERLVQYVKGKTYPFRGAFPPVWNPLAYLDYNNLWRTMDEMGKEIPVDAPWQARHAQEWDKMTMKDLIDKICWTKTAREFAYLFVNINVTSEPHEVSALWFLWYVRQCGGTARIFSVTNGGQERKFVGGSGQVSEQIMGLLGDKVKLSSPVTYIDQTDDNIIVETLNHEHYECKYVISAIPPILTAKIHFKPELPPERNQLIQRLPMGAVIKCMVYYKEAFWKKKDYCGCMIIEDEEAPIAITLDDTKPDGSLPAIMGFILARKADRQAKLHKDIRKRKICELYAKVLGSQEALYPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIYFAGTETATQWSGYMEGAVEAGERAAREVLNALGKVAKKDIWVEEPESKDVPAIEITHTFLERNLPSVPGLLKITGVSTSVALLCFVLYKIKKLPC
  
Inhibitor
Name:
BDBM50168975
Synonyms:
1-(1-Methyl-1H-pyrrol-2-yl)-2-phenyl-2-thiomorpholin-4-yl-ethanone | CHEMBL190268
Type:
Small organic molecule
Emp. Form.:
C17H20N2OS
Mol. Mass.:
300.418
SMILES:
Cn1cccc1C(=O)[C@@H](N1CCSCC1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: