Compound Detail
CHEMBL1195136
SNX 5422 🧪 Phase II
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
🧪 Phase II
CC1(C)CC(=O)c2c(C(F)(F)F)nn(-c3ccc(C(N)=O)c(N[C@H]4CC[C@H](OC(=O)CN)CC4)c3)c2C1
Basic Information
| ChEMBL ID | CHEMBL1195136 |
| Name | SNX 5422 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | AVDSOVJPJZVBTC-CTYIDZIISA-N |
| Active Moiety | CHEMBL560895 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
10
Publications
4
Known Names
4
Indications
1
Mechanisms
Molecular Properties
521.5
MW (Da)
3.37
ALogP
8
HBA
3
HBD
142.3
PSA (Ų)
0.49
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Heat shock protein HSP90 inhibitor | INHIBITOR | Heat shock protein HSP90 | ✓ | ✓ |
Indications
Neoplasms Hematologic Neoplasms Leukemia Lymphoma
Activity Summary
IC50 2 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SiHa CHEMBL612542 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
| Heat shock protein HSP 90-alpha CHEMBL3880 | IC50 | 7.42 | 7.42 | 38.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SiHa | IC50 | = | 14.0 | nM | 7.85 | Antiproliferative activity against human SiHa cells assessed as reduction in cel... | 38861809 |
| Heat shock protein HSP 90-alpha | IC50 | = | 38.0 | nM | 7.42 | Inhibition of recombinant human full length HSP90 alpha expressed in Escherichia... | 32352777 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 38861809 | 10.1016/j.ejmech.2024.116572 | SiHa | 2 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| 32352777 | 10.1021/acs.jmedchem.0c00305 | Heat shock protein HSP 90-alpha | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
| 35224498 | 10.1039/d1md00249j | Bacillus subtilis | 1 |
| 35224498 | 10.1039/d1md00249j | Staphylococcus aureus | 1 |
| 35224498 | 10.1039/d1md00249j | Escherichia coli | 1 |
Data from ChEMBL 36 via Core Engine