Compound Detail
CHEMBL1989158
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C#CCOCCOCCOCCNc1nc(N2CCN(C(=O)CCCCCCCCCCNC(=O)[C@@H](CCSC)n3cc(CCO)nn3)CC2)nc(N2CCN(C(=O)CCCCCCCCCCNC(=O)[C@H]([C@@H](C)CC)n3cc(CCCCN=C(N)N)nn3)CC2)n1
Basic Information
| ChEMBL ID | CHEMBL1989158 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OXQHTVRMFATSBN-FUHXMSDJSA-N |
7
Targets
10
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
1306.8
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 5.78
EC50 2 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Intestinal-type alkaline phosphatase CHEMBL3151 | IC50 | 5.78 | 5.78 | 1660.0 | 1 |
| Insulin-degrading enzyme CHEMBL1293287 | EC50 | 5.63 | 5.63 | 2356.0 | 1 |
| Ubiquitin-conjugating enzyme E2 N CHEMBL6089 | IC50 | 5.42 | 5.33 | 3813.0 | 2 |
| HEK293 CHEMBL614818 | IC50 | 5.35 | 5.35 | 4438.0 | 1 |
| Bcl-2-related protein A1 CHEMBL1293239 | IC50 | 5.26 | 5.26 | 5510.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.01 | 5.01 | 9780.0 | 1 |
| Alkaline phosphatase, tissue-nonspecific isozyme CHEMBL5979 | IC50 | 4.23 | 4.23 | 58700.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.08 | 4.08 | 82680.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine