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Assay Detail

CHEMBL4394198

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

ADMET
Cytotoxicity against human PC3 cells assessed as reduction in cell viability measured after 48 hrs in presence of Staphylococcus saprophyticus nitroreductase and NADH by SRB assay
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Cell Type PC-3
Confidence 1 — Organism
Curated By Autocuration

Target

PC-3 (CHEMBL390)
Type CELL-LINE
Organism Homo sapiens

Publication

PRODRUGS FOR NITROREDUCTASE BASED CANCER THERAPY- 2: Novel amide/Ntr combinations targeting PC3 cancer cells.
Güngör T, Önder FC, Tokay E, Gülhan ÜG, Hacıoğlu N, Tok TT, Çelik A, Köçkar F, Ay M.
Eur J Med Chem (2019) 171 : 383 -400
PubMed 30928710 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 7.03 8.75

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4473679 1 8.75
CHEMBL23330 TRETAZICAR 2.0 1 8.75
CHEMBL4548007 1 8.74
CHEMBL1868530 1 8.74
CHEMBL4454897 1 7.84
CHEMBL4577112 1 7.81
CHEMBL421379 1 7.75
CHEMBL4560417 1 7.52
CHEMBL4543507 1 7.51
CHEMBL123261 1 7.48
CHEMBL4567423 1 7.43
CHEMBL4560599 1 4.99
CHEMBL4453333 1 4.97
CHEMBL4449216 1 4.90
CHEMBL4462402 1 4.77
CHEMBL4542291 1 4.54

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4473679 IC50 = 1.793 nM 8.75
CHEMBL23330 TRETAZICAR IC50 = 1.792 nM 8.75
CHEMBL4548007 IC50 = 1.806 nM 8.74
CHEMBL1868530 IC50 = 1.808 nM 8.74
CHEMBL4454897 IC50 = 14.3 nM 7.84
CHEMBL4577112 IC50 = 15.47 nM 7.81
CHEMBL421379 IC50 = 17.98 nM 7.75
CHEMBL4560417 IC50 = 30.5 nM 7.52
CHEMBL4543507 IC50 = 31.1 nM 7.51
CHEMBL123261 IC50 = 33.43 nM 7.48
CHEMBL4567423 IC50 = 36.83 nM 7.43
CHEMBL4560599 IC50 = 10240.0 nM 4.99
CHEMBL4453333 IC50 = 10720.0 nM 4.97
CHEMBL4449216 IC50 = 12590.0 nM 4.90
CHEMBL4462402 IC50 = 17110.0 nM 4.77
CHEMBL4542291 IC50 = 29120.0 nM 4.54