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Compound Detail

CHEMBL5268653

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COc1ccc([C@H](C)N2CC(=O)N[C@H](C)C(=O)N(CCc3ccccc3Oc3ccccc3)CC(=O)N(c3cc(OC)cc(OC)c3)CC(=O)N(CCCOC(C)C)CC(=O)N([C@@H](C)c3ccc(OC)cc3)CC2=O)cc1

Basic Information

ChEMBL ID CHEMBL5268653
Phase Preclinical
Structure Type MOL
InChI Key QNURSWNKRAWMEW-PYHIYFCPSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

1057.3
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C59H72N6O12
MW 1057.26

Activity Summary

IC50 2 meas. best 6.98

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 6.98 6.98 105.0 1
Catenin beta-1/Transcription factor 7
CHEMBL3885542
IC50 5.26 5.26 5440.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
32871340 10.1016/j.ejmech.2020.112764 Unchecked 1
32871340 10.1016/j.ejmech.2020.112764 Catenin beta-1/Transcription factor 7 1

Data from ChEMBL 36 via Core Engine