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Assay Detail

CHEMBL1228482

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

ADMET
Inhibition of CYP2D6 in human liver microsomes
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

The synthesis and structure-activity relationship of 4-benzimidazolyl-piperidinylcarbonyl-piperidine analogs as histamine H3 antagonists.
Ting PC, Lee JF, Albanese MM, Wu J, Aslanian R, Favreau L, Nardo C, Korfmacher WA, West RE, Williams SM, Anthes JC, Rivelli MA, Corboz MR, Hey JA.
Bioorg Med Chem Lett (2010) 20 : 5004 -5008
PubMed 20685118 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 19 5.22 5.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1222865 1 5.80
CHEMBL1222650 1 5.72
CHEMBL1222863 1 5.43
CHEMBL1222940 1 5.38
CHEMBL1223002 1 5.25
CHEMBL1223001 1 5.24
CHEMBL1222939 1 5.17
CHEMBL1222938 1 5.04
CHEMBL1222800 1 4.98
CHEMBL1223003 1 4.70
CHEMBL1222798 1 4.70
CHEMBL1222799 1 -
CHEMBL1222719 1 -
CHEMBL1222718 1 -
CHEMBL1222717 1 -
CHEMBL1222651 1 -
CHEMBL1222864 1 -
CHEMBL1222649 1 -
CHEMBL1222485 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1222865 IC50 = 1600.0 nM 5.80
CHEMBL1222650 IC50 = 1900.0 nM 5.72
CHEMBL1222863 IC50 = 3700.0 nM 5.43
CHEMBL1222940 IC50 = 4200.0 nM 5.38
CHEMBL1223002 IC50 = 5600.0 nM 5.25
CHEMBL1223001 IC50 = 5800.0 nM 5.24
CHEMBL1222939 IC50 = 6700.0 nM 5.17
CHEMBL1222938 IC50 = 9100.0 nM 5.04
CHEMBL1222800 IC50 = 10500.0 nM 4.98
CHEMBL1223003 IC50 = 20000.0 nM 4.70
CHEMBL1222798 IC50 = 20000.0 nM 4.70
CHEMBL1222799 IC50 > 20000.0 nM -
CHEMBL1222719 IC50 > 20000.0 nM -
CHEMBL1222718 IC50 > 20000.0 nM -
CHEMBL1222717 IC50 > 20000.0 nM -
CHEMBL1222651 IC50 > 20000.0 nM -
CHEMBL1222864 IC50 > 20000.0 nM -
CHEMBL1222649 IC50 > 20000.0 nM -
CHEMBL1222485 IC50 > 20000.0 nM -