Molecule Details
| InChIKey | YJMLPSBGVRXCPM-LADRPBIPSA-N |
|---|---|
| Canonical SMILES | N#Cc1ccc(N2C[C@@H]3[C@H](C2)[C@H]3NCC(=O)N2C[C@@H](F)C[C@H]2C#N)c(Cl)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.6 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q86TI2 | DPP9 | Homo sapiens | Human | PF19520 PF00930 PF00326 | 7.2 | IC50 | ChEMBL;BindingDB |
| P27487 | DPP4 | Homo sapiens | Human | PF00930 PF00326 | 7.0 | IC50 | ChEMBL;BindingDB |
| P48147 | PREP | Homo sapiens | Human | PF00326 PF02897 | 6.4 | IC50 | ChEMBL;BindingDB |
| Q6V1X1 | DPP8 | Homo sapiens | Human | PF19520 PF00930 PF00326 | 6.4 | IC50 | ChEMBL;BindingDB |
| Q9UHL4 | DPP7 | Homo sapiens | Human | PF05577 | 6.0 | IC50 | ChEMBL;BindingDB |