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Assay Detail

CHEMBL3365183

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

Binding
Binding affinity to Trypanosoma cruzi CYP51 by UV-vis titration method
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Trypanosoma cruzi
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Sterol 14-alpha demethylase (CHEMBL1075110)
Type SINGLE PROTEIN
Organism Trypanosoma cruzi (strain CL Brener)

Publication

4-Aminopyridyl-based CYP51 inhibitors as anti-Trypanosoma cruzi drug leads with improved pharmacokinetic profile and in vivo potency.
Calvet CM, Vieira DF, Choi JY, Kellar D, Cameron MD, Siqueira-Neto JL, Gut J, Johnston JB, Lin L, Khan S, McKerrow JH, Roush WR, Podust LM.
J Med Chem (2014) 57 : 6989 -7005
PubMed 25101801 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 14 6.96 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3337534 1 7.92
CHEMBL3337536 1 7.80
CHEMBL3259946 1 7.11
CHEMBL3337532 1 7.10
CHEMBL3337538 1 6.72
CHEMBL3337540 1 6.62
CHEMBL3337537 1 6.54
CHEMBL3337533 1 5.89
CHEMBL507264 1 -
CHEMBL3259944 1 -
CHEMBL3259945 1 -
CHEMBL3337535 1 -
CHEMBL3337539 1 -
CHEMBL3337541 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3337534 Kd = 12.0 nM 7.92
CHEMBL3337536 Kd = 16.0 nM 7.80
CHEMBL3259946 Kd = 77.0 nM 7.11
CHEMBL3337532 Kd = 80.0 nM 7.10
CHEMBL3337538 Kd = 190.0 nM 6.72
CHEMBL3337540 Kd = 240.0 nM 6.62
CHEMBL3337537 Kd = 290.0 nM 6.54
CHEMBL3337533 Kd = 1300.0 nM 5.89
CHEMBL507264 Kd <= 10.0 nM -
CHEMBL3259944 Kd <= 10.0 nM -
CHEMBL3259945 Kd <= 10.0 nM -
CHEMBL3337535 Kd <= 10.0 nM -
CHEMBL3337539 Kd <= 10.0 nM -
CHEMBL3337541 Kd <= 10.0 nM -