Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 3/20 | 0.69 |
| ▸ | LCK | P06239 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | PDCD1 | Q15116 | 5/20 | 0.48 |
| ▸ | CD274 | Q9NZQ7 | 5/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.48 |
| ▸ | ATR | Q13535 | 4/20 | 0.48 |
| ▸ | ATRIP | Q8WXE1 | 4/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6625645 | 0.91 | PIK3CB (0.78) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6626031 | 0.89 | PIK3CB (0.74) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6626232 | 0.87 | PIK3CB (0.70) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL4118961 | 0.86 | PIK3CB (0.69) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6625425 | 0.85 | PIK3CB (0.67) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6625181 | 0.85 | PIK3CB (0.67) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6625200 | 0.84 | PIK3CB (0.74) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6624863 | 0.84 | PIK3CB (0.66) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6629587 | 0.83 | PIK3CB (0.65) | PIK3CBLCKPDCD1CD274CHEK1 | |
| SCHEMBL6629606 | 0.82 | PIK3CB (1.00) | PIK3CBLCKMKNK1MKNK2PIK3CD |
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 |