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Compound Detail

CHEMBL322959

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CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(N)ccc1c2[Si](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL322959
Phase Preclinical
Structure Type MOL
InChI Key DMTSPIIGVQTUPQ-QHCPKHFHSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

435.6
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H25N3O4Si
MW 435.56

Activity Summary

IC50 3 meas. best 8.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
HL-60
CHEMBL383
 IC50 8.59 8.59 2.6 1
DC3F
CHEMBL612702
 IC50 8.19 8.19 6.4 1
833K
CHEMBL613103
 IC50 8.13 8.13 7.4 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
HL-60 IC50 = 2.6 nM 8.59 Tested in vitro for growth inhibitory activity against HL60 (human promyelocytic... -
DC3F IC50 = 6.4 nM 8.19 Tested in vitro for growth inhibitory activity against DC-3F (hamster lung) cell... -
833K IC50 = 7.4 nM 8.13 Tested in vitro for growth inhibitory activity against 833K (human teratorcarcin... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(97)10181-0 Unchecked 2
- 10.1016/S0960-894X(97)10181-0 HL-60 1
- 10.1016/S0960-894X(97)10181-0 833K 1
- 10.1016/S0960-894X(97)10181-0 DC3F 1

Data from ChEMBL 36 via Core Engine