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Compound Detail

CHEMBL4455300

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NC(=O)CC[C@H](NC(=O)[C@@H]1CC[C@@H]2CCN(C(=O)CCN3CCC(C#Cc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)CC3)C[C@H](NC(=O)c3cc4cc(C(F)(F)P(=O)(O)O)ccc4[nH]3)C(=O)N21)C(=O)NC(c1ccccc1)c1ccccc1

Basic Information

ChEMBL ID CHEMBL4455300
Phase Preclinical
Structure Type MOL
InChI Key FDBBKBSMSHLUPL-RNJJLJFWSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

1199.2
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C61H65F2N10O12P
MW 1199.22

Activity Summary

IC50 1 meas. best 6.44

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 6.44 6.44 360.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 360.0 nM 6.44 Antiproliferative activity against human MOLM16 cells assessed as reduction in c... 31747516

Literature References

PubMed DOI Target Context # Activities
31747516 10.1021/acs.jmedchem.9b01530 Protein cereblon/STAT3 2
31747516 10.1021/acs.jmedchem.9b01530 Unchecked 1
31747516 10.1021/acs.jmedchem.9b01530 SU-DHL-1 1

Data from ChEMBL 36 via Core Engine