Compound Detail
CHEMBL2304308
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CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)CNC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC1=O
Basic Information
| ChEMBL ID | CHEMBL2304308 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GRUDSXXHTCXYAX-VZLRIKMUSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1573.8
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 6.85
IC50 1 meas. best 5.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| IgG receptor FcRn large subunit p51 CHEMBL5966 | Kd | 6.85 | 6.44 | 140.0 | 2 |
| IgG receptor FcRn large subunit p51 CHEMBL5966 | IC50 | 5.72 | 5.72 | 1900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| IgG receptor FcRn large subunit p51 | Kd | = | 140.0 | nM | 6.85 | Binding affinity to soluble human FcRn at pH 6 by surface plasmon resonance assa... | 20092334 |
| IgG receptor FcRn large subunit p51 | Kd | = | 930.0 | nM | 6.03 | Binding affinity to soluble human FcRn at pH 7.4 by surface plasmon resonance as... | 20092334 |
| IgG receptor FcRn large subunit p51 | IC50 | = | 1900.0 | nM | 5.72 | Inhibition of IgG binding to soluble human FcRn after 5 hrs by competition ELISA | 20092334 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20092334 | 10.1021/jm901128z | IgG receptor FcRn large subunit p51 | 3 |
Data from ChEMBL 36 via Core Engine