Compound Detail
CHEMBL454320
TRICIN Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL454320 |
| Name | TRICIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HRGUSFBJBOKSML-UHFFFAOYSA-N |
4
Targets
7
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
330.3
MW (Da)
2.59
ALogP
7
HBA
3
HBD
109.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A CHEMBL1951 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Aldo-keto reductase family 1 member B1 CHEMBL1900 | IC50 | 5.69 | 5.69 | 2030.0 | 1 |
| RBL-2H3 CHEMBL614632 | IC50 | 5.32 | 5.32 | 4830.0 | 1 |
| RAW264.7 CHEMBL612557 | IC50 | 5.1 | 4.66 | 8000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A | IC50 | = | 250.0 | nM | 6.6 | Inhibition of recombinant human MAO-A using kynuramine as substrate incubated fo... | 32942081 |
| Aldo-keto reductase family 1 member B1 | IC50 | = | 2030.0 | nM | 5.69 | Inhibition of aldose reductase (unknown origin) | - |
| RBL-2H3 | IC50 | = | 4830.0 | nM | 5.32 | Antihistaminic activity in rat RBL2H3 cells assessed as inhibition of DNP-BSA-in... | 14510616 |
| RAW264.7 | IC50 | = | 8000.0 | nM | 5.1 | Inhibition of LPS/INF-gamma-stimulated nitric oxide production in mouse RAW264.7... | 27955927 |
| RAW264.7 | IC50 | = | 28000.0 | nM | 4.55 | Anti-inflammatory activity in LPS-stimulated mouse RAW264.7 cells assessed as in... | 37683361 |
| RAW264.7 | IC50 | = | 46410.0 | nM | 4.33 | Anti-inflammatory activity in LPS-stimulated mouse RAW264.7 cells assessed as in... | 37683361 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21319803 | 10.1021/jm1015457 | Plasma | 3 |
| 16038557 | 10.1021/np0580107 | Radical scavenging activity | 3 |
| 16038557 | 10.1021/np0580107 | Cladosporium cucumerinum | 3 |
| 25497988 | 10.1016/j.bmcl.2014.11.054 | RAW264.7 | 3 |
| 16038557 | 10.1021/np0580107 | Candida albicans | 2 |
| 29254644 | 10.1016/j.bmcl.2017.12.014 | Unchecked | 2 |
| 37683361 | 10.1016/j.ejmech.2023.115791 | RAW264.7 | 2 |
| 7320737 | 10.1021/np50017a003 | P388 | 2 |
| 12608861 | 10.1021/np020231e | Streptococcus pneumoniae | 1 |
| 12608861 | 10.1021/np020231e | Stenotrophomonas maltophilia | 1 |
| 12608861 | 10.1021/np020231e | Cryptococcus neoformans | 1 |
| 12608861 | 10.1021/np020231e | Enterobacter cloacae | 1 |
| 12608861 | 10.1021/np020231e | Micrococcus luteus | 1 |
| 12608861 | 10.1021/np020231e | KM-20L2 | 1 |
| 12608861 | 10.1021/np020231e | NCI-H460 | 1 |
| 12608861 | 10.1021/np020231e | SF-268 | 1 |
| 12608861 | 10.1021/np020231e | MCF7 | 1 |
| 12608861 | 10.1021/np020231e | BXPC-3 | 1 |
| 12608861 | 10.1021/np020231e | P388 | 1 |
| 14510616 | 10.1021/np030020p | ADMET | 1 |
Data from ChEMBL 36 via Core Engine