Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8931160 | 0.78 | PIK3C3 (0.50) | PIK3C3ALDH1A1F10CNR1KMT2A | |
| SCHEMBL31108710 | 0.78 | KDM4E (0.41) | ALDH1A1TMPRSS4TDP1KMT2APPARG | |
| SCHEMBL8828399 | 0.77 | PIK3C3 (0.49) | PIK3C3ALDH1A1CNR1KMT2AMTOR | |
| SCHEMBL15999462 | 0.76 | ALDH1A1 (0.56) | PIK3C3ALDH1A1CNR1KMT2ALRRK2 | |
| SCHEMBL22890272 | 0.76 | LRRK2 (0.40) | ALDH1A1TMPRSS4TDP1LRRK2AR | |
| SCHEMBL8828590 | 0.76 | PIK3C3 (0.48) | PIK3C3ALDH1A1CNR1KMT2ALRRK2 | |
| SCHEMBL8548977 | 0.73 | PIK3C3 (0.46) | PIK3C3ALDH1A1CNR1KMT2ALRRK2 | |
| SCHEMBL8828506 | 0.71 | PIK3C3 (0.41) | PIK3C3ALDH1A1CNR1KMT2A | |
| SCHEMBL30033113 | 0.71 | FLT1 (0.48) | ALDH1A1MTORCCNE1CDK2AR | |
| SCHEMBL13943063 | 0.69 | EGLN1 (0.40) | ALDH1A1CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5688795-A | URINARY TRACTS OBSTRUCTION | SYNTEX (U.S.A.) INC. (US) | 1997-11-18 | — | — | US | disclosed |
| EP-0711757-A1 | 3-(4-phenylpiperazin-1-yl)propyl-amino, thio and oxy -pyridine, pyrimidine and benzene derivatives as alpha1-adrenoceptor antagonists | F. Hoffmann-La Roche AG (CH) | 1996-05-15 | — | — | EP | disclosed |