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Assay Detail

CHEMBL4604696

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

ADMET
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate incubated for 12 min in presence of NADPH by LC-MS/MS analysis
13
Total Activities
13
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 2D6 (CHEMBL289)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Development of 3-(6-Chloropyridine-3-yloxymethyl)-2-azabicyclo[3.1.0]hexane Hydrochloride (SUVN-911): A Novel, Potent, Selective, and Orally Active Neuronal Nicotinic Acetylcholine α4β2 Receptor Antagonist for the Treatment of Depression.
Nirogi R, Mohammed AR, Shinde AK, Ravella SR, Bogaraju N, Subramanian R, Mekala VR, Palacharla RC, Muddana N, Thentu JB, Bhyrapuneni G, Abraham R, Jasti V.
J Med Chem (2020) 63 : 2833 -2853
PubMed 32026697 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 4.48 4.77

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4641810 1 4.77
CHEMBL4643942 1 4.58
CHEMBL4643543 1 4.52
CHEMBL4649507 1 4.49
CHEMBL4642118 1 4.42
CHEMBL4642287 1 4.10
CHEMBL4645127 1 -
CHEMBL4638732 1 -
CHEMBL4642865 1 -
CHEMBL4645367 1 -
CHEMBL4636163 1 -
CHEMBL4647198 1 -
CHEMBL4641432 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4641810 IC50 = 17100.0 nM 4.77
CHEMBL4643942 IC50 = 26200.0 nM 4.58
CHEMBL4643543 IC50 = 30200.0 nM 4.52
CHEMBL4649507 IC50 = 32100.0 nM 4.49
CHEMBL4642118 IC50 = 38100.0 nM 4.42
CHEMBL4642287 IC50 = 79000.0 nM 4.10
CHEMBL4645127 IC50 > 42000.0 nM -
CHEMBL4638732 IC50 > 45000.0 nM -
CHEMBL4642865 IC50 > 45000.0 nM -
CHEMBL4645367 IC50 > 45000.0 nM -
CHEMBL4636163 IC50 > 45000.0 nM -
CHEMBL4647198 IC50 > 45000.0 nM -
CHEMBL4641432 IC50 > 45000.0 nM -