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Assay Detail

CHEMBL939876

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

ADMET
Binding affinity to CYP2D6
4
Total Activities
4
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Cytochrome P450 2D6 (CHEMBL289)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Antagonists of the calcium receptor I. Amino alcohol-based parathyroid hormone secretagogues.
Marquis RW, Lago AM, Callahan JF, Trout RE, Gowen M, DelMar EG, Van Wagenen BC, Logan S, Shimizu S, Fox J, Nemeth EF, Yang Z, Roethke T, Smith BR, Ward KW, Lee J, Keenan RM, Bhatnagar P.
J Med Chem (2009) 52 : 3982 -3993
PubMed 19492813 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 4 6.95 7.44

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL504479 1 7.44
CHEMBL2112075 1 7.35
CHEMBL523475 1 7.12
CHEMBL486278 1 5.90

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL504479 IC50 = 36.0 nM 7.44
CHEMBL2112075 IC50 = 45.0 nM 7.35
CHEMBL523475 IC50 = 76.0 nM 7.12
CHEMBL486278 IC50 = 1260.0 nM 5.90