Molecule Details
| InChIKey | LAMPPZAYRXOJOM-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(trifluoromethoxy)phenyl]benzamide |
| Canonical SMILES | O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(CN2CCc3ccccc3C2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.41 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P01375 | TNF | Homo sapiens | Human | PF00229 | 7.6 | IC50 | ChEMBL;BindingDB |
| Q9HC29 | NOD2 | Homo sapiens | Human | PF00619 PF13516 PF05729 PF17776 PF17779 | 7.5 | IC50 | ChEMBL;BindingDB |
| Q9Y239 | NOD1 | Homo sapiens | Human | PF00619 PF13516 PF05729 PF17776 PF17779 | 7.1 | IC50 | ChEMBL;BindingDB |