Compound Detail
CHEMBL1209678
CHEILANTHIFOLINE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1209678 |
| Name | CHEILANTHIFOLINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FVXCQULKSPVRPK-UHFFFAOYSA-N |
7
Targets
8
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
325.4
MW (Da)
2.79
ALogP
5
HBA
1
HBD
51.2
PSA (Ų)
0.87
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 5.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 5.73 | 5.73 | 1880.0 | 1 |
| A549 CHEMBL392 | IC50 | 4.69 | 4.69 | 20630.0 | 1 |
| SK-MEL-2 CHEMBL614917 | IC50 | 4.65 | 4.65 | 22240.0 | 1 |
| SK-OV-3 CHEMBL614925 | IC50 | 4.56 | 4.56 | 27410.0 | 1 |
| HCT-15 CHEMBL612263 | IC50 | 4.53 | 4.53 | 29840.0 | 1 |
| HGC-27 CHEMBL1075463 | IC50 | 4.42 | 4.42 | 38300.0 | 1 |
| MGC-803 CHEMBL3706566 | IC50 | 4.08 | 4.08 | 83200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 1880.0 | nM | 5.73 | Antiinflammatory activity against mouse RAW264.7 cells assessed as inhibition of... | 29853329 |
| A549 | IC50 | = | 20630.0 | nM | 4.69 | Cytotoxicity against human A549 cells by SRB assay | 20594848 |
| SK-MEL-2 | IC50 | = | 22240.0 | nM | 4.65 | Cytotoxicity against human SK-MEL-2 cells by SRB assay | 20594848 |
| SK-OV-3 | IC50 | = | 27410.0 | nM | 4.56 | Cytotoxicity against human SKOV3 cells by SRB assay | 20594848 |
| HCT-15 | IC50 | = | 29840.0 | nM | 4.53 | Cytotoxicity against human HCT15 cells by SRB assay | 20594848 |
| HGC-27 | IC50 | = | 38300.0 | nM | 4.42 | Antiproliferative activity against human HGC-27 cells assessed as reduction in c... | 35286954 |
| MGC-803 | IC50 | = | 83200.0 | nM | 4.08 | Antiproliferative activity against human MGC-803 cells assessed as reduction in ... | 35286954 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20594848 | 10.1016/j.bmcl.2010.06.035 | A549 | 1 |
| 20594848 | 10.1016/j.bmcl.2010.06.035 | SK-OV-3 | 1 |
| 20594848 | 10.1016/j.bmcl.2010.06.035 | SK-MEL-2 | 1 |
| 20594848 | 10.1016/j.bmcl.2010.06.035 | HCT-15 | 1 |
| 29853329 | 10.1016/j.bmcl.2018.05.039 | RAW264.7 | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | MGC-803 | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | HGC-27 | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | GES1 | 1 |
Data from ChEMBL 36 via Core Engine