Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7375114 | 0.78 | ITGB3 (0.51) | AKR1C3ITGB3ITGA2BALDH1A1HPGD | |
| SCHEMBL7862019 | 0.76 | LMNA (0.45) | PARP1PARP10ITGB3ITGA2BALDH1A1 | |
| SCHEMBL9323576 | 0.73 | L3MBTL1 (0.54) | PARP1PARP10ALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL7452316 | 0.73 | ITGB3 (0.57) | PARP1PARP10ITGB3ITGA2BALDH1A1 | |
| SCHEMBL13703191 | 0.73 | ITGB3 (0.57) | PARP1PARP10ITGB3ITGA2BSMN1; SMN2 | |
| SCHEMBL7377400 | 0.73 | MAPT (0.47) | AKR1C3ALDH1A1SMN1; SMN2NPC1HPGD | |
| SCHEMBL7455765 | 0.72 | ITGB3 (0.58) | ITGB3ITGA2BALDH1A1NPC1RAB9A | |
| SCHEMBL7099298 | 0.72 | ITGB3 (0.66) | ITGB3ITGA2BSMN1; SMN2ITGAV | |
| SCHEMBL7864175 | 0.71 | ALDH1A1 (0.47) | PARP1PARP10ITGB3ITGA2BALDH1A1 | |
| SCHEMBL7863259 | 0.71 | PKM (0.46) | ITGB3ALDH1A1SMN1; SMN2L3MBTL1HPGD |
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-0891325-A1 | PARA-SUBSTITUTED PHENYLPROPANOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1999-01-20 | — | — | EP | disclosed |
| WO-1997036859-A1 | PARA-SUBSTITUTED PHENYLPROPANOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1997-10-09 | — | — | WO | disclosed |