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Compound Detail

CHEMBL5430090

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Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(OCC(=O)N4CCC(CN5CCC(CN6CCN(c7cccc8c7C(=O)N(C7CCC(=O)NC7=O)C8=O)CC6)CC5)CC4)cc3)CC2)c1[N+](=O)[O-]

Basic Information

ChEMBL ID CHEMBL5430090
Phase Preclinical
Structure Type MOL
InChI Key PUWBPSLIEAYIKX-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

1033.6
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C53H61ClN10O10
MW 1033.58

Activity Summary

IC50 1 meas. best 6.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
HT-1080
CHEMBL614580
IC50 6.0 6.0 1000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
HT-1080 IC50 = 1000.0 nM 6.0 Antiproliferative activity against human HT-1080 cells assessed as reduction in ... 37087895

Literature References

PubMed DOI Target Context # Activities
37087895 10.1016/j.ejmech.2023.115343 Protein cereblon/Phospholipid hydroperoxide glutathione peroxidase 1
37087895 10.1016/j.ejmech.2023.115343 HT-1080 1

Data from ChEMBL 36 via Core Engine