Compound Detail
CHEMBL1090969
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CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)C(=O)N2CCC[C@H]2C(=O)N[C@H](C(N)=O)CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]2C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc3ccc(NC(=N)N)cc3)C(=O)NCC(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)C(=O)N3CCC[C@H]3C(=O)N[C@H](C(N)=O)CSSC2(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc2ccc(NC(=N)N)cc2)C(=O)NCC(=O)N(C)CC(=O)N1C
Basic Information
| ChEMBL ID | CHEMBL1090969 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OOPGUWBDBVXBMU-MCJNUYKLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
2999.5
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| IgG receptor FcRn large subunit p51 CHEMBL5966 | IC50 | 7.7 | 7.7 | 20.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| IgG receptor FcRn large subunit p51 | IC50 | = | 20.0 | nM | 7.7 | 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 | 2 |
| 20092334 | 10.1021/jm901128z | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine