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Assay Detail

CHEMBL5152875

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

Binding
Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hrs by Rapidfire mass spectrometric analysis
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Ceramide glucosyltransferase (CHEMBL2063)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Photoredox-based late-stage functionalization in SAR study for in vivo potent glucosylceramide synthase inhibitor.
Wang J, Reynolds M, Ibáñez I, Sasaki Y, Tanaka Y, Kikuchi F, Ohashi T, Sato S, Miyabayashi M, Fujii T, Tanaka Y.
Bioorg Med Chem Lett (2022) 77 : 129039 -129039
PubMed 36341811 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 7.86 8.44

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5181454 1 8.44
CHEMBL5197585 1 8.37
CHEMBL5178033 1 8.23
CHEMBL5193757 1 8.13
CHEMBL5198393 1 8.04
CHEMBL5185934 1 8.00
CHEMBL5182659 1 7.96
CHEMBL5183525 1 7.89
CHEMBL5186203 1 7.80
CHEMBL5185095 1 7.80
CHEMBL5186505 1 7.66
CHEMBL5200972 1 7.28
CHEMBL5192371 1 6.60

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5181454 IC50 = 3.6 nM 8.44
CHEMBL5197585 IC50 = 4.3 nM 8.37
CHEMBL5178033 IC50 = 5.9 nM 8.23
CHEMBL5193757 IC50 = 7.4 nM 8.13
CHEMBL5198393 IC50 = 9.2 nM 8.04
CHEMBL5185934 IC50 = 10.0 nM 8.00
CHEMBL5182659 IC50 = 11.0 nM 7.96
CHEMBL5183525 IC50 = 13.0 nM 7.89
CHEMBL5186203 IC50 = 16.0 nM 7.80
CHEMBL5185095 IC50 = 16.0 nM 7.80
CHEMBL5186505 IC50 = 22.0 nM 7.66
CHEMBL5200972 IC50 = 53.0 nM 7.28
CHEMBL5192371 IC50 = 250.0 nM 6.60