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Compound Detail

CHEMBL3647709

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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](CCCNC(=N)N)NC(=O)[C@H](NC[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@@H]2C[C@@H]3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)CCCCNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O

Basic Information

ChEMBL ID CHEMBL3647709
Phase Preclinical
Structure Type MOL
InChI Key FUIWABOFKJDPGP-KUONXOGPSA-N
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

1619.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C87H111N17O12S
MW 1619.02

Activity Summary

Ki 4 meas. best 9.62

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 2
CHEMBL1804
Ki 9.62 9.62 0.2 1
Somatostatin receptor type 5
CHEMBL1792
Ki 9.09 9.09 0.8 1
Somatostatin receptor type 1
CHEMBL1917
Ki 7.98 7.98 10.4 1
D(2) dopamine receptor
CHEMBL217
Ki 7.82 7.82 15.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine