Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 4/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPRA | P18433 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3963654 | 0.89 | PTPRB (0.34) | DGAT1PTPRBPTPN1PTPN2PTPRA | |
| SCHEMBL16994587 | 0.80 | ALDH1A1 (0.33) | PTPRB | |
| SCHEMBL23856832 | 0.80 | PTPRB (0.30) | PTPRB | |
| SCHEMBL20627096 | 0.77 | PTPRB (0.32) | PTPRBPTPN1PTPN2PTPRA | |
| SCHEMBL17358192 | 0.77 | — | — | |
| SCHEMBL14727963 | 0.77 | DGAT1 (0.37) | DGAT1CTSK | |
| SCHEMBL11449724 | 0.75 | DGAT1 (0.35) | DGAT1CTSK | |
| SCHEMBL23857751 | 0.74 | GRIK1 (0.32) | — | |
| SCHEMBL30253452 | 0.73 | ALDH1A1 (0.30) | — | |
| SCHEMBL30440750 | 0.71 | DGAT1 (0.54) | DGAT1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4126855-A1 | COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION | F. Hoffmann-La Roche AG (CH) | 2023-02-08 | — | — | EP | disclosed |