Molecule Details
| InChIKey | VFLDPWHFBUODDF-UHFFFAOYSA-N |
|---|---|
| Compound Name | 1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione |
| Canonical SMILES | COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.32 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P13726 | F3 | Homo sapiens | Human | PF09294 PF01108 | 6.7 | IC50 | BindingDB |
| P00918 | CA2 | Homo sapiens | Human | PF00194 | 6.4 | Ki | BindingDB |
| Q13547 | HDAC1 | Homo sapiens | Human | PF00850 | 6.3 | Ki | BindingDB |
| O14684 | PTGES | Homo sapiens | Human | PF01124 | 6.2 | IC50 | BindingDB |
| P09917 | ALOX5 | Homo sapiens | Human | PF00305 PF01477 | 6.2 | IC50 | BindingDB |
| P05067 | APP | Homo sapiens | Human | PF10515 PF12924 PF12925 PF02177 PF03494 PF00014 | 6.1 | IC50 | BindingDB |