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Compound Detail

CHEMBL4464623

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CC(C)[C@H](NC(=O)c1ccncc1)C(=O)N1CCC[C@H]1B(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4464623
Phase Preclinical
Structure Type MOL
InChI Key MXZNUGFCDVAXLG-STQMWFEESA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

319.2
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H22BN3O4
MW 319.17

Activity Summary

IC50 1 meas. best 8.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Prolyl endopeptidase
CHEMBL3202
 IC50 8.89 8.89 1.3 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Prolyl endopeptidase IC50 = 1.3 nM 8.89 Inhibition of POP (unknown origin) 31393718

Literature References

PubMed DOI Target Context # Activities
31393718 10.1021/acs.jmedchem.9b00642 Prolyl endopeptidase FAP 1
31393718 10.1021/acs.jmedchem.9b00642 Prolyl endopeptidase 1

Data from ChEMBL 36 via Core Engine