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Compound Detail

CHEMBL500326

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C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](N)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC1=O

Basic Information

ChEMBL ID CHEMBL500326
Phase Preclinical
Structure Type BOTH
InChI Key PJRZZHKHLDKTKL-YXXMKNPKSA-N
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

1079.3
MW (Da)

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C54H66N10O10S2
MW 1079.32

Activity Summary

IC50 5 meas. best 9.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 4
CHEMBL1853
IC50 9.0 9.0 1.0 1
Somatostatin receptor type 3
CHEMBL2028
IC50 8.35 8.35 4.5 1
Somatostatin receptor type 5
CHEMBL1792
IC50 8.02 8.02 9.5 1
Somatostatin receptor type 1
CHEMBL1917
IC50 7.85 7.85 14.0 1
Somatostatin receptor type 2
CHEMBL1804
IC50 7.84 7.84 14.5 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
18410084 10.1021/jm701444y Somatostatin receptor type 1 1
18410084 10.1021/jm701444y Somatostatin receptor type 2 1
18410084 10.1021/jm701444y Somatostatin receptor type 3 1
18410084 10.1021/jm701444y Somatostatin receptor type 5 1
18410084 10.1021/jm701444y Somatostatin receptor type 4 1

Data from ChEMBL 36 via Core Engine