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Assay Detail

CHEMBL3413433

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human MAO-A expressed in baculovirus infected BTI insect cells preincubated for 15 mins
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Amine oxidase [flavin-containing] A (CHEMBL1951)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

N-Methyl-N-((1-methyl-5-(3-(1-(2-methylbenzyl)piperidin-4-yl)propoxy)-1H-indol-2-yl)methyl)prop-2-yn-1-amine, a new cholinesterase and monoamine oxidase dual inhibitor.
Bautista-Aguilera OM, Samadi A, Chioua M, Nikolic K, Filipic S, Agbaba D, Soriano E, de Andrés L, Rodríguez-Franco MI, Alcaro S, Ramsay RR, Ortuso F, Yañez M, Marco-Contelles J.
J Med Chem (2014) 57 : 10455 -10463
PubMed 25418133 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 5.94 8.33

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL8706 CLORGILINE 2.0 1 8.33
CHEMBL3407581 1 8.20
CHEMBL1929421 1 7.24
CHEMBL3407582 1 6.59
CHEMBL45069 1 6.54
CHEMBL3407586 1 6.06
CHEMBL3407587 1 5.04
CHEMBL3407583 1 5.04
CHEMBL3407588 1 4.99
CHEMBL3407584 1 4.72
CHEMBL3407585 1 4.34
CHEMBL972 SELEGILINE 4.0 1 4.20
CHEMBL3407590 1 -
CHEMBL3407589 1 -
CHEMBL502 DONEPEZIL 4.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL8706 CLORGILINE IC50 = 4.7 nM 8.33
CHEMBL3407581 IC50 = 6.3 nM 8.20
CHEMBL1929421 IC50 = 58.2 nM 7.24
CHEMBL3407582 IC50 = 257.6 nM 6.59
CHEMBL45069 IC50 = 287.3 nM 6.54
CHEMBL3407586 IC50 = 876.6 nM 6.06
CHEMBL3407587 IC50 = 9100.0 nM 5.04
CHEMBL3407583 IC50 = 9100.0 nM 5.04
CHEMBL3407588 IC50 = 10300.0 nM 4.99
CHEMBL3407584 IC50 = 19200.0 nM 4.72
CHEMBL3407585 IC50 = 45300.0 nM 4.34
CHEMBL972 SELEGILINE IC50 = 63600.0 nM 4.20
CHEMBL3407590 IC50 = 310600.0 nM -
CHEMBL3407589 IC50 = 630100.0 nM -
CHEMBL502 DONEPEZIL IC50 - -