Molecule Details
| InChIKey | YNGXWVIJSUJZSG-UHFFFAOYSA-N |
|---|---|
| Compound Name | Akr1B10-IN-1 |
| Canonical SMILES | O=C(NCCCc1ccc(F)cc1)c1cc2ccc(O)cc2oc1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.8 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| O60218 | AKR1B10 | Homo sapiens | Human | PF00248 | 8.5 | IC50 | ChEMBL;BindingDB |
| P15121 | AKR1B1 | Homo sapiens | Human | PF00248 | 6.6 | IC50 | ChEMBL;BindingDB |
| P17516 | AKR1C4 | Homo sapiens | Human | PF00248 | 6.5 | IC50 | ChEMBL;BindingDB |
| P42330 | AKR1C3 | Homo sapiens | Human | PF00248 | 6.3 | IC50 | ChEMBL;BindingDB |
| P52895 | AKR1C2 | Homo sapiens | Human | PF00248 | 6.2 | IC50 | ChEMBL;BindingDB |