Compound Detail
CHEMBL3786111
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 | CHEMBL3786111 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SRRZNTSQMBBURS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
449.9
MW (Da)
4.17
ALogP
5
HBA
0
HBD
66.1
PSA (Ų)
0.44
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bcap37 CHEMBL613842 | IC50 | 4.62 | 4.62 | 24210.0 | 1 |
| Telomerase reverse transcriptase CHEMBL2916 | IC50 | 4.24 | 4.24 | 57790.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bcap37 | IC50 | = | 24210.0 | nM | 4.62 | Cytotoxicity against human Bcap37 cells after 48 hrs by MTT assay | 26900656 |
| Telomerase reverse transcriptase | IC50 | = | 57790.0 | nM | 4.24 | Inhibition of telomerase in human MGC-803 cells after 24 hrs by TRAP-PCR-ELISA a... | 26900656 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26900656 | 10.1016/j.ejmech.2016.02.009 | NON-PROTEIN TARGET | 2 |
| 26900656 | 10.1016/j.ejmech.2016.02.009 | Telomerase reverse transcriptase | 1 |
| 26900656 | 10.1016/j.ejmech.2016.02.009 | HepG2 | 1 |
| 26900656 | 10.1016/j.ejmech.2016.02.009 | Bcap37 | 1 |
Data from ChEMBL 36 via Core Engine