Compound Detail
CHEMBL4283742
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
N=C(N)Nc1nc(-c2ccc(N3CCN(CCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCOCCC(=O)NCCOCCOCCOCCN4CCN(c5ccc(-c6c(Cl)ccc7nc(NC(=N)N)ncc67)cc5)CC4)CC3)cc2)c2cc(Cl)ccc2n1
Basic Information
| ChEMBL ID | CHEMBL4283742 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDRLIPKWQVVDCP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
1416.5
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium/hydrogen exchanger 3 CHEMBL3273 | IC50 | 8.58 | 8.58 | 2.6 | 1 |
| Sodium/hydrogen exchanger 3 CHEMBL3879842 | IC50 | 7.68 | 7.68 | 20.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium/hydrogen exchanger 3 | IC50 | = | 2.63 | nM | 8.58 | Inhibition of human NHE3 expressed in OK cells assessed as reduction in Na+ depe... | - |
| Sodium/hydrogen exchanger 3 | IC50 | = | 20.89 | nM | 7.68 | Inhibition of rat NHE3 expressed in OK cells assessed as reduction in Na+ depend... | - |
Data from ChEMBL 36 via Core Engine