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Compound Detail

CHEMBL4757608

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CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(N)=O)[C@@H](C)O

Basic Information

ChEMBL ID CHEMBL4757608
Phase Preclinical
Structure Type MOL
InChI Key SJXDGWLWUDVWGO-DRMPQPDHSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

1126.4
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C47H91N21O11
MW 1126.38

Activity Summary

Ki 1 meas. best 8.05

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Furin
CHEMBL2611
Ki 8.05 8.05 9.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Furin Ki = 9.0 nM 8.05 Inhibition of recombinant soluble human furin using pyroGlu-Arg-Thr-Lys-Arg-meth... 33738063

Literature References

PubMed DOI Target Context # Activities
33738063 10.1021/acsmedchemlett.0c00386 Furin 1

Data from ChEMBL 36 via Core Engine