Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18030278 | 0.91 | ALDH1A1 (0.45) | ALDH1A1TP53CYP3A4IRAK4 | |
| SCHEMBL12234441 | 0.89 | ALDH1A1 (0.43) | ALDH1A1TP53CYP3A4MGLLLMNA | |
| SCHEMBL12234443 | 0.89 | ALDH1A1 (0.43) | ALDH1A1TP53CYP3A4MGLLIRAK4 | |
| SCHEMBL18691824 | 0.86 | ALDH1A1 (0.43) | ALDH1A1TP53CYP3A4MGLLLMNA | |
| SCHEMBL12234487 | 0.86 | ALDH1A1 (0.43) | ALDH1A1TP53CYP3A4MGLL | |
| SCHEMBL1834660 | 0.85 | ALDH1A1 (0.35) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL1834656 | 0.85 | ALDH1A1 (0.35) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL377540 | 0.84 | ALDH1A1 (0.57) | ALDH1A1TP53CYP3A4MGLL | |
| SCHEMBL16244518 | 0.84 | ALDH1A1 (0.42) | ALDH1A1TP53CYP3A4MGLLLMNA | |
| SCHEMBL21804854 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TP53CYP3A4MGLLLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1289977-A2 | TRITERPENOID DERIVATIVES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | Univerzita palackeho V Olomouci (CZ) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001090096-A2 | TRITERPENOID DERIVATIVES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | UNIVERZITA PALACKEHO V OLOMOUCI (CZ) | 2001-11-29 | — | — | WO | disclosed |