Compound Detail
CHEMBL253982
ERIANTHRIDIN Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL253982 |
| Name | ERIANTHRIDIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NWPBSPADEDDKAO-UHFFFAOYSA-N |
5
Targets
9
Activities
2
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
272.3
MW (Da)
2.88
ALogP
4
HBA
2
HBD
58.9
PSA (Ų)
0.88
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 6.52
EC50 2 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.52 | 5.45 | 300.0 | 3 |
| No relevant target CHEMBL2362975 | IC50 | 4.83 | 4.83 | 14900.0 | 1 |
| RAW264.7 CHEMBL612557 | IC50 | 4.71 | 4.71 | 19500.0 | 1 |
| HL-60 CHEMBL383 | IC50 | 4.35 | 4.35 | 44600.0 | 1 |
| BV-2 CHEMBL614781 | IC50 | 4.03 | 4.03 | 93500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 300.0 | nM | 6.52 | Antiinflammatory activity in human neutrophils assessed as inhibition of FMLP/cy... | 27525452 |
| NON-PROTEIN TARGET | IC50 | = | 2000.0 | nM | 5.7 | Antiinflammatory activity in human neutrophils assessed as inhibition of fMLP/CB... | 27525452 |
| No relevant target | IC50 | = | 14900.0 | nM | 4.83 | Antioxidant activity assessed as DPPH radical scavenging activity | 29280630 |
| RAW264.7 | IC50 | = | 19500.0 | nM | 4.71 | Antiinflammatory activity in mouse RAW264.7 cells assessed as inhibition of LPS-... | 20483604 |
| HL-60 | IC50 | = | 44600.0 | nM | 4.35 | Cytotoxicity against human HL60 cells after 72 hrs by WST8 assay | 22537363 |
| NON-PROTEIN TARGET | IC50 | = | 73200.0 | nM | 4.13 | Antiproliferative activity against rat HSC-T6 cells after 48 hrs by MTT assay | 18052323 |
| BV-2 | IC50 | = | 93500.0 | nM | 4.03 | Antineuroinflammatory activity against mouse BV2 cells assessed as inhibition of... | 31415170 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23234371 | 10.1021/np300508v | Aorta | 6 |
| 27310249 | 10.1021/acs.jnatprod.6b00252 | NON-PROTEIN TARGET | 6 |
| 27310249 | 10.1021/acs.jnatprod.6b00252 | Molecular identity unknown | 5 |
| 27525452 | 10.1021/acs.jnatprod.6b00118 | NON-PROTEIN TARGET | 2 |
| 18052323 | 10.1021/np070423f | Hepatocyte | 1 |
| 18052323 | 10.1021/np070423f | NON-PROTEIN TARGET | 1 |
| 20483604 | 10.1016/j.bmcl.2010.04.054 | RAW264.7 | 1 |
| 22537363 | 10.1021/np200788u | HL-60 | 1 |
| 27310249 | 10.1021/acs.jnatprod.6b00252 | Colletotrichum truncatum | 1 |
| 31415170 | 10.1021/acs.jnatprod.9b00291 | BV-2 | 1 |
| 29280630 | 10.1021/acs.jnatprod.7b00619 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine