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Assay Detail

CHEMBL4675900

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

ADMET
Inhibition of CYP2C19 in human liver microsomes using probe substrate and in presence of co-factor preincubated for 20 mins followed by substrate addition by LC-MS/MS analysis
2
Total Activities
2
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Tissue Liver
Subcellular Microsomes
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cytochrome P450 2C19 (CHEMBL3622)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of 9-Cyclopropylethynyl-2-((S)-1-[1,4]dioxan-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one (GLPG1205), a Unique GPR84 Negative Allosteric Modulator Undergoing Evaluation in a Phase II Clinical Trial.
Labéguère F,Dupont S,Alvey L,Soulas F,Newsome G,Tirera A,Quenehen V,Mai TTT,Deprez P,Blanqué R,Oste L,Le Tallec S,De Vos S,Hagers A,Vandevelde A,Nelles L,Vandervoort N,Conrath K,Christophe T,van der Aar E,Wakselman E,Merciris D,Cottereaux C,da Costa C,Saniere L,Clement-Lacroix P,Jenkins L,Milligan G,Fletcher S,Brys R,Gosmini R
J Med Chem (2020) 63 : 13526 -13545
PubMed 32902984 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 2 4.74 4.74

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3717363 1 4.74
CHEMBL3716365 GLPG-1205 2.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3717363 IC50 = 18200.0 nM 4.74
CHEMBL3716365 GLPG-1205 IC50 > 100000.0 nM -