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Compound Detail

CHEMBL5612636

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Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCNC(=O)c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)C(C)(C)C)cc1

Basic Information

ChEMBL ID CHEMBL5612636
Phase Preclinical
Structure Type MOL
InChI Key UZPUYHARAXYZLT-KZDWPBSFSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

1002.3
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C53H67N11O7S
MW 1002.26

Activity Summary

IC50 1 meas. best 8.25

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
CDK7/Cyclin H/MNAT1
CHEMBL3038473
IC50 8.25 8.25 5.6 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
39004018 10.1016/j.ejmech.2024.116613 von Hippel-Lindau disease tumor suppressor/Cyclin-dependent kinase 7 2
39004018 10.1016/j.ejmech.2024.116613 CDK7/Cyclin H/MNAT1 1

Data from ChEMBL 36 via Core Engine