Molecule Details
| InChIKey | LVKWYVRJCVWPCV-MFOYZWKCSA-N |
|---|---|
| Compound Name | [2-Chloro-4-({2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-methoxyphenoxy]acetic acid |
| Canonical SMILES | COc1cc(/C=C2\SC(=O)N(CC(=O)Nc3ccc(C)cc3)C2=O)cc(Cl)c1OCC(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.42 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P35236 | PTPN7 | Homo sapiens | Human | PF00102 | 6.6 | IC50 | ChEMBL;BindingDB |
| Q05209 | PTPN12 | Homo sapiens | Human | PF00102 | 6.5 | IC50 | ChEMBL |
| Q9Y6K1 | DNMT3A | Homo sapiens | Human | PF17980 PF00145 PF22855 PF21255 PF00855 | 6.5 | IC50 | BindingDB |
| Q9Y2R2 | PTPN22 | Homo sapiens | Human | PF00102 | 6.1 | IC50 | ChEMBL;BindingDB |