Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.39 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8103349 | 0.86 | GSK3B (0.61) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL29411099 | 0.80 | PTPN1 (1.00) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL220588 | 0.80 | PTPN1 (1.00) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL316378 | 0.78 | TSHR (0.48) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL11482012 | 0.73 | PTPN1 (0.84) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL11647490 | 0.73 | MEN1 (0.56) | PTPN1HPGDKDM4EALDH1A1RAB9A | |
| Naphthalene SCHEMBL28739292 | 0.72 | GSK3B (0.86) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL571370 | 0.71 | GSK3B (0.71) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL31065275 | 0.71 | GSK3B (0.71) | PTPN1HPGDSMN1; SMN2KDM4EGSK3B | |
| SCHEMBL28835358 | 0.70 | GSK3B (0.60) | PTPN1SMN1; SMN2GSK3BALDH1A1NPC1 |
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-0971901-B1 | PHTHALAZINONES | ALTANA PHARMA AG (DE) | 2003-02-26 | — | — | EP | disclosed |