Compound Detail
CHEMBL1087512
LECANINDOLE B 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
CC1(C)C(=O)CC[C@]2(C)[C@@]3(C)c4[nH]c5ccccc5c4C[C@@H]3CC[C@@]12O
Basic Information
| ChEMBL ID | CHEMBL1087512 |
| Name | LECANINDOLE B |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JQTRPSHLFTZYHC-SESVXGAZSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
351.5
MW (Da)
4.52
ALogP
2
HBA
2
HBD
53.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 9.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Progesterone receptor CHEMBL208 | EC50 | 9.52 | 9.52 | 0.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Progesterone receptor | EC50 | = | 0.3 | nM | 9.52 | Activation of progesterone receptor in human T47D cells after 20 hrs by PRE-tagg... | 19863083 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19863083 | 10.1021/np9004882 | Progesterone receptor | 3 |
| 19863083 | 10.1021/np9004882 | Androgen receptor | 3 |
| 19863083 | 10.1021/np9004882 | Mineralocorticoid receptor | 3 |
| 19863083 | 10.1021/np9004882 | Estrogen receptor beta | 3 |
| 19863083 | 10.1021/np9004882 | Estrogen receptor | 3 |
| 19863083 | 10.1021/np9004882 | Glucocorticoid receptor | 2 |
Data from ChEMBL 36 via Core Engine