Compound Detail
CHEMBL1288318
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Basic Information
| ChEMBL ID | CHEMBL1288318 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YGNSZPMASIQLDX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
238.2
MW (Da)
2.03
ALogP
5
HBA
1
HBD
63.8
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage migration inhibitory factor CHEMBL2085 | Ki | 4.43 | 4.43 | 37000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage migration inhibitory factor | Ki | = | 37000.0 | nM | 4.43 | Inhibition of recombinant human MIF expressed in Escherichia coli using HPP as s... | 29812929 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20971005 | 10.1016/j.bmcl.2010.09.118 | MIF/CD74 (Macrophage migration inhibitory factor and HLA-DR antigens-associated invariant chain) | 2 |
| 20971005 | 10.1016/j.bmcl.2010.09.118 | Macrophage migration inhibitory factor | 2 |
| 29812929 | 10.1021/acs.jmedchem.8b00589 | Macrophage migration inhibitory factor | 1 |
Data from ChEMBL 36 via Core Engine