Molecule Details
| InChIKey | VCBCUVKYTUDCRS-UHFFFAOYSA-N |
|---|---|
| Compound Name | N-tert-Butyl-2-[[6-cyano-1-(3-methyl-3H-imidazol-4-yl-methyl)-1,2,3,4-tetrahydroquinolin-3-yl]-(1-methyl-1H-imidazole-2-sulfonyl)amino]acetamide |
| Canonical SMILES | Cn1cncc1CN1CC(N(CC(=O)NC(C)(C)C)S(=O)(=O)c2nccn2C)Cc2cc(C#N)ccc21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.2 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P49354 | FNTA | Homo sapiens | Human | PF01239 | 8.3 | IC50 | ChEMBL;BindingDB |
| P49356 | FNTB | Homo sapiens | Human | PF00432 | 8.3 | IC50 | ChEMBL |
| Q5E175 | rhlE | Aliivibrio fischeri (strain ATCC 700601 / ES114) | Pathogen | PF00270 PF00271 | 8.1 | IC50 | BindingDB |
| Q5EI73 | Plasmodium falciparum | Pathogen | PF01239 | 8.1 | IC50 | ChEMBL |