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Assay Detail

CHEMBL1068898

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

ADMET
Inhibition of human CYP2CD6 by fluorescence assay
12
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

1-(Aryl)-6-[alkoxyalkyl]-3-azabicyclo[3.1.0]hexanes and 6-(aryl)-6-[alkoxyalkyl]-3-azabicyclo[3.1.0]hexanes: a new series of potent and selective triple reuptake inhibitors.
Micheli F, Cavanni P, Arban R, Benedetti R, Bertani B, Bettati M, Bettelini L, Bonanomi G, Braggio S, Checchia A, Davalli S, Di Fabio R, Fazzolari E, Fontana S, Marchioro C, Minick D, Negri M, Oliosi B, Read KD, Sartori I, Tedesco G, Tarsi L, Terreni S, Visentini F, Zocchi A, Zonzini L.
J Med Chem (2010) 53 : 2534 -2551
PubMed 20170186 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 5.79 6.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL610220 1 6.52
CHEMBL598644 1 6.00
CHEMBL610795 1 6.00
CHEMBL2021577 1 5.40
CHEMBL608151 2 5.40
CHEMBL609023 1 -
CHEMBL590472 1 -
CHEMBL2021582 1 -
CHEMBL598215 1 -
CHEMBL605209 1 -
CHEMBL596809 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL610220 IC50 = 300.0 nM 6.52
CHEMBL598644 IC50 = 1000.0 nM 6.00
CHEMBL610795 IC50 = 1000.0 nM 6.00
CHEMBL2021577 IC50 = 4000.0 nM 5.40
CHEMBL608151 IC50 = 4000.0 nM 5.40
CHEMBL608151 IC50 = 4000.0 nM 5.40
CHEMBL609023 IC50 < 100.0 nM -
CHEMBL590472 IC50 > 10000.0 nM -
CHEMBL2021582 IC50 > 5000.0 nM -
CHEMBL598215 IC50 > 4000.0 nM -
CHEMBL605209 IC50 > 8000.0 nM -
CHEMBL596809 IC50 > 6000.0 nM -