Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 6/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.49 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.47 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.46 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 4/20 | 0.46 |
| ▸ | CTSS | P25774 | 4/20 | 0.46 |
| ▸ | CTSK | P43235 | 4/20 | 0.46 |
| ▸ | CTSB | P07858 | 3/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6629606 | 0.90 | PIK3CB (1.00) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL6625427 | 0.90 | PIK3CB (1.00) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL3594472 | 0.85 | PIK3CB (0.90) | PIK3CBKDM4EALDH1A1MAPK1HSD17B10 | |
| SCHEMBL20078072 | 0.84 | PIK3CB (0.87) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL6626404 | 0.84 | PIK3CB (0.87) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL927196 | 0.84 | PIK3CB (0.87) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL6627240 | 0.83 | PIK3CB (0.85) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL6626263 | 0.83 | PIK3CB (0.85) | PIK3CBKDM4EALDH1A1HSD17B10PIK3CD | |
| SCHEMBL6625463 | 0.83 | PIK3CB (0.85) | PIK3CBPIK3CDPIK3CAPIK3CGLCK | |
| SCHEMBL6625296 | 0.82 | PIK3CB (0.83) | PIK3CBPIK3CDPIK3CAPIK3CGLCK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1020462-B1 | HETEROCYCLIC COMPOUNDS AND ANTITUMOR AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT | ZENYAKU KOGYO KK (JP) | 2004-02-11 | — | — | EP | disclosed |
| US-6251900-B1 | Heterocyclic compounds and antitumor agent containing the same as active ingredient | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 2001-06-26 | — | — | US | disclosed |
| EP-1020462-A1 | HETEROCYCLIC COMPOUNDS AND ANTITUMOR AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 2000-07-19 | — | — | EP | disclosed |