Compound Detail
CHEMBL226396
6-CHLOROGUANINE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL226396 |
| Name | 6-CHLOROGUANINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RYYIULNRIVUMTQ-UHFFFAOYSA-N |
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
169.6
MW (Da)
0.59
ALogP
4
HBA
2
HBD
80.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 8.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 8.3 | 8.3 | 5.0 | 1 |
| Plasmodium falciparum CHEMBL364 | IC50 | 5.0 | 4.585 | 10000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 | IC50 | = | 5.0 | nM | 8.3 | Inhibition of dipeptidyl peptidase 4 (unknown origin) | - |
| Plasmodium falciparum | IC50 | = | 10000.0 | nM | 5.0 | Antiplasmodial activity against Plasmodium falciparum 3D7 | 17149876 |
| Plasmodium falciparum | IC50 | = | 67000.0 | nM | 4.17 | Inhibition of [3H]hypoxanthine uptake in Plasmodium falciparum 3D7 | 17149876 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17149876 | 10.1021/jm061012j | Plasmodium falciparum | 2 |
| 20921305 | 10.1128/aac.01029-10 | Bacillus anthracis | 2 |
| 17149876 | 10.1021/jm061012j | Hypoxanthine-guanine phosphoribosyltransferase | 1 |
| 17149876 | 10.1021/jm061012j | Unchecked | 1 |
| 17379526 | 10.1016/j.bmc.2007.03.010 | Xanthine dehydrogenase/oxidase | 1 |
| 20921305 | 10.1128/aac.01029-10 | J774.A1 | 1 |
| - | 10.1007/s00044-012-0455-6 | Dipeptidyl peptidase 4 | 1 |
| 22217465 | 10.1124/dmd.111.043000 | Hepatocyte | 1 |
| 26599519 | 10.1021/acs.jmedchem.5b01616 | Cytosolic purine 5'-nucleotidase | 1 |
| 28933546 | 10.1021/acs.jmedchem.7b01066 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine