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Target
Amine oxidase [flavin-containing] B
Ligand
BDBM50093330
Substrate
n/a
Meas. Tech.
ChEMBL_1501996 (CHEMBL3588480)
IC50
39±n/a nM
Citation
 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Structure-Based Design and Optimization of Multitarget-Directed 2H-Chromen-2-one Derivatives as Potent Inhibitors of Monoamine Oxidase B and Cholinesterases. J Med Chem 58:5561-78 (2015) [PubMed]  Article 
Target
Name:
Amine oxidase [flavin-containing] B
Synonyms:
AOFB_HUMAN | MAO-B | MAOB | Monoamine oxidase type B | Monoamine oxidase type B (MAO B) | Monoamine oxidase type B (MAO B) | Monoamine oxidase type B (MAOB)
Type:
Protein
Mol. Mass.:
58768.76
Organism:
Homo sapiens (Human)
Description:
P27338
Residue:
520
Sequence:
MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQKVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHHVKGKSYPFRGPFPPVWNPITYLDHNNFWRTMDDMGREIPSDAPWKAPLAEEWDNMTMKELLDKLCWTESAKQLATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFVGGSGQVSERIMDLLGDRVKLERPVIYIDQTRENVLVETLNHEMYEAKYVISAIPPTLGMKIHFNPPLPMMRNQMITRVPLGSVIKCIVYYKEPFWRKKDYCGTMIIDGEEAPVAYTLDDTKPEGNYAAIMGFILAHKARKLARLTKEERLKKLCELYAKVLGSLEALEPVHYEEKNWCEEQYSGGCYTTYFPPGILTQYGRVLRQPVDRIYFAGTETATHWSGYMEGAVEAGERAAREILHAMGKIPEDEIWQSEPESVDVPAQPITTTFLERHLPSVPGLLRLIGLTTIFSATALGFLAHKRGLLVRV
  
Inhibitor
Name:
BDBM50093330
Synonyms:
CHEMBL3586604
Type:
Small organic molecule
Emp. Form.:
C27H25ClN2O3
Mol. Mass.:
460.952
SMILES:
Cl.CN(Cc1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1)Cc1ccc(cc1)C#N
Structure:
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