Compound Detail
CHEMBL405074
MERIOLIN 7 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL405074 |
| Name | MERIOLIN 7 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NFOHQNIARGGZFN-UHFFFAOYSA-N |
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
285.3
MW (Da)
1.63
ALogP
6
HBA
2
HBD
98.9
PSA (Ų)
0.69
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 5.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDK9/cyclin T1 CHEMBL2111389 | IC50 | 5.28 | 5.28 | 5300.0 | 1 |
| Cyclin-dependent kinase 5/CDK5 activator 1 CHEMBL1907600 | IC50 | 4.85 | 4.85 | 14000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.46 | 4.22 | 35000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDK9/cyclin T1 | IC50 | = | 5300.0 | nM | 5.28 | Inhibition of human recombinant CDK9/cyclin T expressed in insect cells | 18232649 |
| Cyclin-dependent kinase 5/CDK5 activator 1 | IC50 | = | 14000.0 | nM | 4.85 | Inhibition of recombinant GST-CDK5/p25 expressed in Escherichia coli | 18232649 |
| Unchecked | IC50 | = | 35000.0 | nM | 4.46 | Inhibition of starfish oocyte CDK1/cyclin B | 18232649 |
| Unchecked | IC50 | = | 63000.0 | nM | 4.2 | Inhibition of pig GSK-3-alpha/GSK-3beta | 18232649 |
| Unchecked | IC50 | = | 100000.0 | nM | 4.0 | Inhibition of pig CK1delta/CK1epsilon | 18232649 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18232649 | 10.1021/jm700940h | Unchecked | 3 |
| 18232649 | 10.1021/jm700940h | Cyclin-dependent kinase | 3 |
| 18232649 | 10.1021/jm700940h | Cyclin-dependent kinase 2/cyclin A | 1 |
| 18232649 | 10.1021/jm700940h | Cyclin-dependent kinase 5/CDK5 activator 1 | 1 |
| 18232649 | 10.1021/jm700940h | CDK9/cyclin T1 | 1 |
| 18232649 | 10.1021/jm700940h | Dual specificity tyrosine-phosphorylation-regulated kinase 1A | 1 |
| 18232649 | 10.1021/jm700940h | SH-SY5Y | 1 |
| 18232649 | 10.1021/jm700940h | HEK293 | 1 |
| 18232649 | 10.1021/jm700940h | GBM | 1 |
| 18232649 | 10.1021/jm700940h | KMS-11 | 1 |
| 18232649 | 10.1021/jm700940h | LS174T | 1 |
Data from ChEMBL 36 via Core Engine