Molecule Details
| InChIKey | SOYCFODXNRVBTI-UHFFFAOYSA-N |
|---|---|
| Compound Name | A-1155463 |
| Canonical SMILES | CN(C)CC#Cc1ccc(OCCCc2sc(N3CCc4cccc(C(=O)Nc5nc6ccccc6s5)c4C3)nc2C(=O)O)c(F)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.25 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q07817 | BCL2L1 | Homo sapiens | Human | PF00452 PF02180 | 9.6 | IC50 | ChEMBL;BindingDB |
| Q92843 | BCL2L2 | Homo sapiens | Human | PF00452 PF02180 | 7.7 | Ki | ChEMBL;BindingDB |
| P10415 | BCL2 | Homo sapiens | Human | PF00452 PF02180 | 7.1 | Ki | ChEMBL;BindingDB |
| Q99720 | SIGMAR1 | Homo sapiens | Human | PF04622 | 6.9 | Ki | ChEMBL |
| P14867 | GABRA1 | Homo sapiens | Human | PF02931 PF02932 | 6.1 | Ki | ChEMBL |
| Q5BJF2 | TMEM97 | Homo sapiens | Human | PF05241 | 6.1 | Ki | ChEMBL |