Molecule Details
| InChIKey | UJLHNYPXKZJKLV-MTJYQENUSA-N |
|---|---|
| Compound Name | CID 90186611 |
| Canonical SMILES | O=C(O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1)c1cccc(S(=O)(=O)NC(C(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 24 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 9.95 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (24)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| O00408 | PDE2A | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| O43924 | PDE6D | Homo sapiens | Human | PF05351 | 10.0 | IC50 | ChEMBL;BindingDB |
| O60658 | PDE8A | Homo sapiens | Human | PF00989 PF08629 PF23198 PF00233 | 10.0 | IC50 | ChEMBL |
| O76074 | PDE5A | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| O76083 | PDE9A | Homo sapiens | Human | PF00233 | 10.0 | IC50 | ChEMBL |
| O95263 | PDE8B | Homo sapiens | Human | PF13426 PF08629 PF23198 PF00233 | 10.0 | IC50 | ChEMBL |
| P16499 | PDE6A | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| P18545 | PDE6G | Homo sapiens | Human | PF04868 | 10.0 | IC50 | ChEMBL |
| P27815 | PDE4A | Homo sapiens | Human | PF18100 PF00233 | 10.0 | IC50 | ChEMBL |
| P35913 | PDE6B | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| P51160 | PDE6C | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| P54750 | PDE1A | Homo sapiens | Human | PF00233 PF08499 | 10.0 | IC50 | ChEMBL |
| Q01064 | PDE1B | Homo sapiens | Human | PF00233 PF08499 | 10.0 | IC50 | ChEMBL |
| Q07343 | PDE4B | Homo sapiens | Human | PF18100 PF00233 | 10.0 | IC50 | ChEMBL |
| Q08493 | PDE4C | Homo sapiens | Human | PF18100 PF00233 | 10.0 | IC50 | ChEMBL |
| Q08499 | PDE4D | Homo sapiens | Human | PF18100 PF00233 | 10.0 | IC50 | ChEMBL |
| Q13370 | PDE3B | Homo sapiens | Human | PF00233 | 10.0 | IC50 | ChEMBL |
| Q13946 | PDE7A | Homo sapiens | Human | PF00233 | 10.0 | IC50 | ChEMBL |
| Q13956 | PDE6H | Homo sapiens | Human | PF04868 | 10.0 | IC50 | ChEMBL |
| Q14123 | PDE1C | Homo sapiens | Human | PF00233 PF08499 | 10.0 | IC50 | ChEMBL |
| Q14432 | PDE3A | Homo sapiens | Human | PF00233 | 10.0 | IC50 | ChEMBL |
| Q9NP56 | PDE7B | Homo sapiens | Human | PF00233 | 10.0 | IC50 | ChEMBL |
| Q9Y233 | PDE10A | Homo sapiens | Human | PF01590 PF00233 | 10.0 | IC50 | ChEMBL |
| P20309 | CHRM3 | Homo sapiens | Human | PF00001 | 8.9 | Ki | ChEMBL;BindingDB |