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Compound Detail

CHEMBL229284

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Cc1cn([C@H]2CC[C@@H](OCP(=O)(O)O)O2)c(=O)[nH]c1=O.O=P(O)(O)OP(=O)(O)O

Basic Information

ChEMBL ID CHEMBL229284
Phase Preclinical
Structure Type MOL
InChI Key YJNVRDXTKUQTMR-WLYNEOFISA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

484.2
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H19N2O14P3
MW 484.18

Activity Summary

IC50 1 meas. best 5.27

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Human immunodeficiency virus type 1 reverse transcriptase
CHEMBL247
IC50 5.27 5.27 5400.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Human immunodeficiency virus type 1 reverse transcriptase IC50 = 5400.0 nM 5.27 Inhibition of HIV1 reverse transcriptase 17562366

Literature References

PubMed DOI Target Context # Activities
17562366 10.1016/j.bmc.2007.05.047 Human immunodeficiency virus 1 1
17562366 10.1016/j.bmc.2007.05.047 Human immunodeficiency virus type 1 reverse transcriptase 1
17562366 10.1016/j.bmc.2007.05.047 MT2 1

Data from ChEMBL 36 via Core Engine