Molecule Details
| InChIKey | ILDDTQOAULOQBC-UHFFFAOYSA-N |
|---|---|
| Compound Name | 6-fluoro-5-[1-[3-methyl-4-(1-methylpyrazol-4-yl)phenyl]piperidin-4-yl]-5H-imidazo[5,1-a]isoindole |
| Canonical SMILES | Cc1cc(N2CCC(C3c4c(F)cccc4-c4cncn43)CC2)ccc1-c1cnn(C)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.84 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P14902 | IDO1 | Homo sapiens | Human | PF01231 | 7.4 | IC50 | ChEMBL;BindingDB |
| P48775 | TDO2 | Homo sapiens | Human | PF03301 | 6.9 | IC50 | ChEMBL;BindingDB |
| P08684 | CYP3A4 | Homo sapiens | Human | PF00067 | 6.5 | IC50 | ChEMBL;BindingDB |
| P11712 | CYP2C9 | Homo sapiens | Human | PF00067 | 6.5 | IC50 | ChEMBL;BindingDB |