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Compound Detail

CHEMBL284377

DEXFOSFOSERINE
🧪 Phase II
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🧪 Phase II
N[C@@H](COP(=O)(O)O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284377
Name DEXFOSFOSERINE
Phase Phase II
Structure Type MOL
InChI Key BZQFBWGGLXLEPQ-REOHCLBHSA-N

Known Names

Dexfosfoserina Dexfosfoserine Dl-o-phosphorylserine Dl-phosphoserine Energoserina Fosforina GNF-PF-1028 L-o-phosphoserine L-o-serine phosphate L-phosphoserine NSC-760136 NSC-90791 +7 more
4
Targets
11
Activities
3
Assay Types
1
PK Parameters
20
Publications
19
Known Names

Molecular Properties

185.1
MW (Da)
-1.49
ALogP
4
HBA
4
HBD
130.1
PSA (Ų)
0.39
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product
USAN Stem -fos-

Extended Properties

Molecular Formula C3H8NO6P
MW 185.07
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 1.18

Activity Summary

EC50 6 meas. best 6.0
Ki 4 meas.
IC50 1 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Metabotropic glutamate receptor 4
CHEMBL2736
 EC50 6.0 5.945 1000.0 2
Plasmodium falciparum
CHEMBL364
 EC50 5.97 5.97 1080.0 1
Metabotropic glutamate receptor 6
CHEMBL3842
 EC50 5.57 5.57 2700.0 1
Metabotropic glutamate receptor 4
CHEMBL2787
 EC50 5.4 5.4 4000.0 1

Pharmacokinetic Data

Parameter Value Units Species
KA 0.1 mM Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Metabotropic glutamate receptor 4 EC50 = 1000.0 nM 6.0 Agonistic activity at Metabotropic glutamate receptor 4 expressed in mammalian c... 10888329
Plasmodium falciparum EC50 = 1080.0 nM 5.97 NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferati... 18579783
Metabotropic glutamate receptor 4 EC50 = 1300.0 nM 5.89 Concentration for half maximal activation of metabotropic glutamate mGluR4a in h... 7738999
Metabotropic glutamate receptor 6 EC50 = 2700.0 nM 5.57 Concentration for half maximal activation of metabotropic glutamate mGluR6 in ra... 7738999
Metabotropic glutamate receptor 4 EC50 = 4000.0 nM 5.4 Concentration for half maximal activation of metabotropic glutamate mGluR4a in r... 7738999

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
7738999 10.1021/jm00009a001 Metabotropic glutamate receptor 4 2
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
18579783 10.1073/pnas.0802982105 Plasmodium falciparum 2
7738999 10.1021/jm00009a001 Metabotropic glutamate receptor 7 2
15745821 10.1016/j.bmcl.2005.01.049 Carbonic anhydrase 2 1
15745821 10.1016/j.bmcl.2005.01.049 Carbonic anhydrase 4 1
15745821 10.1016/j.bmcl.2005.01.049 Carbonic anhydrase 5A, mitochondrial 1
15745821 10.1016/j.bmcl.2005.01.049 Carbonic anhydrase 9 1
15801843 10.1021/jm049092j Metabotropic glutamate receptor 4 1
17567119 10.1021/jm070133w Glutamate carboxypeptidase 2 1
17485504 10.1128/aac.01184-06 Lethal factor 1
15745821 10.1016/j.bmcl.2005.01.049 Carbonic anhydrase 1 1
18579783 10.1073/pnas.0802982105 Unchecked 1
18579783 10.1073/pnas.0802982105 Huh-7 1
17417631 10.1038/nchembio873 Unchecked 1
24373842 10.1016/j.bmc.2013.12.006 Unchecked 1
30143366 10.1016/j.bmc.2018.08.012 Metabotropic glutamate receptor 2 1
7738999 10.1021/jm00009a001 Metabotropic glutamate receptor 6 1

Data from ChEMBL 36 via Core Engine