Compound Detail
CHEMBL487397
LANTALUCRATIN E Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL487397 |
| Name | LANTALUCRATIN E |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IGQHQXQDGDLBTH-UHFFFAOYSA-N |
5
Targets
6
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
318.3
MW (Da)
2.01
ALogP
6
HBA
2
HBD
93.1
PSA (Ų)
0.81
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 1A9 CHEMBL614075 | IC50 | 5.89 | 5.745 | 1300.0 | 2 |
| MCF7 CHEMBL387 | IC50 | 5.26 | 5.26 | 5500.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
| A549 CHEMBL392 | IC50 | 5.06 | 5.06 | 8700.0 | 1 |
| HOS CHEMBL614736 | IC50 | 5.06 | 5.06 | 8700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 1A9 | IC50 | = | 1300.0 | nM | 5.89 | Cytotoxicity against human 1A9 cells after 3 days by SRB assay | 15217280 |
| 1A9 | IC50 | = | 2500.0 | nM | 5.6 | Cytotoxicity against paclitaxel-resistant human 1A9 cells after 3 days by SRB as... | 15217280 |
| MCF7 | IC50 | = | 5500.0 | nM | 5.26 | Cytotoxicity against human MCF7 cells after 3 days by SRB assay | 15217280 |
| NON-PROTEIN TARGET | IC50 | = | 7000.0 | nM | 5.16 | Cytotoxicity against human U87MG cells after 3 days by SRB assay | 15217280 |
| A549 | IC50 | = | 8700.0 | nM | 5.06 | Cytotoxicity against human A549 cells after 3 days by SRB assay | 15217280 |
| HOS | IC50 | = | 8700.0 | nM | 5.06 | Cytotoxicity against human HOS cells after 3 days by SRB assay | 15217280 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15217280 | 10.1021/np030450f | KB | 4 |
| 15217280 | 10.1021/np030450f | 1A9 | 2 |
| 15217280 | 10.1021/np030450f | CAKI-1 | 2 |
| 15217280 | 10.1021/np030450f | A549 | 1 |
| 15217280 | 10.1021/np030450f | MCF7 | 1 |
| 15217280 | 10.1021/np030450f | HOS | 1 |
| 15217280 | 10.1021/np030450f | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine