Compound Detail
CHEMBL3900537
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CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(N)=O)C(C)C)C(C)C
Basic Information
| ChEMBL ID | CHEMBL3900537 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | LQJJAKPRMPSDKG-WNTFTJOUSA-N |
2
Targets
7
Activities
3
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
2442.9
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.68
IC50 3 meas. best 6.88
Kd 1 meas. best 7.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 7.08 | 7.08 | 82.7 | 1 |
| Tissue factor pathway inhibitor CHEMBL3713062 | IC50 | 6.88 | 6.88 | 133.0 | 3 |
| Tissue factor pathway inhibitor CHEMBL3713062 | EC50 | 5.68 | 5.68 | 2100.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine