Compound Detail
CHEMBL4859032
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Basic Information
| ChEMBL ID | CHEMBL4859032 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YLZBJJAYAZWHIA-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
3
PK Parameters
5
Publications
0
Known Names
Molecular Properties
334.1
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leishmania donovani CHEMBL367 | EC50 | 5.92 | 5.92 | 1200.0 | 1 |
| Leishmania infantum CHEMBL612848 | EC50 | 5.51 | 5.51 | 3100.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 7900.0 | ng.hr.mL-1 | Mesocricetus auratus |
| CL | 11.9 | mL.min-1.g-1 | Homo sapiens |
| CL | 57.0 | mL.min-1.g-1 | Mesocricetus auratus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leishmania donovani | EC50 | = | 1200.0 | nM | 5.92 | Antileishmanial activity against amastigote stage of Leishmania donovani MHOM/ET... | 34711050 |
| Leishmania infantum | EC50 | = | 3100.0 | nM | 5.51 | Antileishmanial activity against amastigote stage of Leishmania infantum MHOM/MA... | 34711050 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34711050 | 10.1021/acs.jmedchem.1c01437 | Leishmania infantum | 13 |
| 34711050 | 10.1021/acs.jmedchem.1c01437 | ADMET | 4 |
| 34711050 | 10.1021/acs.jmedchem.1c01437 | Peritoneal macrophage | 1 |
| 34711050 | 10.1021/acs.jmedchem.1c01437 | Leishmania donovani | 1 |
| 34711050 | 10.1021/acs.jmedchem.1c01437 | MRC5 | 1 |
Data from ChEMBL 36 via Core Engine