Molecule Details
| InChIKey | XHLNYQWMGGXIOS-UHFFFAOYSA-N |
|---|---|
| Compound Name | 9,10-dimethyl-1,2,3,4-tetrahydro-5H-benzo[c]furo[3,2-g]chromen-5-one |
| Canonical SMILES | Cc1oc2cc3oc(=O)c4c(c3cc2c1C)CCCC4 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.07 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| O94788 | ALDH1A2 | Homo sapiens | Human | PF00171 | 7.2 | IC50 | ChEMBL;BindingDB |
| P05091 | ALDH2 | Homo sapiens | Human | PF00171 | 7.2 | IC50 | ChEMBL;BindingDB |
| P30837 | ALDH1B1 | Homo sapiens | Human | PF00171 | 7.0 | IC50 | ChEMBL;BindingDB |
| P00352 | ALDH1A1 | Homo sapiens | Human | PF00171 | 6.9 | IC50 | ChEMBL;BindingDB |