Compound Detail
CHEMBL446236
OSCILLAMIDE Y 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
CC[C@@H](C)[C@@H]1NC(=O)[C@H](NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O)CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CCc2ccc(O)cc2)NC1=O
Basic Information
| ChEMBL ID | CHEMBL446236 |
| Name | OSCILLAMIDE Y |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KCAKUFQSCADGHZ-JNFDXLRCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
858.0
MW (Da)
2.28
ALogP
9
HBA
9
HBD
255.6
PSA (Ų)
0.13
QED
2
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Carboxypeptidase B2 CHEMBL3419 | IC50 | 6.4 | 6.4 | 400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Carboxypeptidase B2 | IC50 | = | 400.0 | nM | 6.4 | Inhibition of human activated TAFI incubated for 15 mins by microtiter plate rea... | 25990761 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11520225 | 10.1021/np0005356 | Unchecked | 3 |
| 11520225 | 10.1021/np0005356 | Dual specificity protein phosphatase 3 | 1 |
| 11520225 | 10.1021/np0005356 | M-phase inducer phosphatase 2 | 1 |
| - | 10.1021/np960108l | Unchecked | 1 |
| 25990761 | 10.1021/jm501840b | Coagulation factor XI | 1 |
| 25990761 | 10.1021/jm501840b | Prothrombin | 1 |
| 25990761 | 10.1021/jm501840b | Coagulation factor VII | 1 |
| 25990761 | 10.1021/jm501840b | Coagulation factor X | 1 |
| 25990761 | 10.1021/jm501840b | Carboxypeptidase N catalytic chain | 1 |
| 25990761 | 10.1021/jm501840b | Carboxypeptidase A1 | 1 |
| 25990761 | 10.1021/jm501840b | Carboxypeptidase B2 | 1 |
Data from ChEMBL 36 via Core Engine