Compound Detail
CHEMBL1241238
CYCLOMARIN A Enter ChEMBL ID:
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C=C[C@H](C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](OC)c2ccccc2)NC(=O)[C@H](C)NC(=O)[C@H](C[C@@H](C)CO)N(C)C(=O)C[C@@H]([C@H](O)c2cn(C(C)(C)[C@@H]3CO3)c3ccccc23)NC1=O
Basic Information
| ChEMBL ID | CHEMBL1241238 |
| Name | CYCLOMARIN A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DPTAYQSHBQTKDP-OVVICRQNSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1043.3
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.57 | 7.4525 | 27.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 27.0 | nM | 7.57 | Antimalarial activity against NITD609-resistant Plasmodium falciparum Dd2 Clone3... | 20813948 |
| Plasmodium falciparum | IC50 | = | 32.0 | nM | 7.5 | Antimalarial activity against Plasmodium falciparum Dd2 after 72 hrs by SYBR gre... | 20813948 |
| Plasmodium falciparum | IC50 | = | 35.0 | nM | 7.46 | Antimalarial activity against NITD609-resistant Plasmodium falciparum Dd2 Clone2... | 20813948 |
| Plasmodium falciparum | IC50 | = | 53.0 | nM | 7.28 | Antimalarial activity against NITD609-resistant Plasmodium falciparum Dd2 Clone1... | 20813948 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20813948 | 10.1126/science.1193225 | Plasmodium falciparum | 4 |
Data from ChEMBL 36 via Core Engine