Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 4/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7528584 | 0.81 | GRM5 (0.48) | MAOBALDH1A1GAA | |
| SCHEMBL7518230 | 0.80 | KDM4E (0.40) | MAOBRAPGEF4ALDH1A1GAACA1 | |
| SCHEMBL7517596 | 0.80 | ALDH1A1 (0.54) | EGFRALDH1A1CA1 | |
| SCHEMBL7520161 | 0.78 | KIF11 (0.52) | RAPGEF4ALDH1A1GAA | |
| SCHEMBL7524850 | 0.73 | IDO1 (0.47) | IDO1RAPGEF4NCOA1NCOA3EGFR | |
| SCHEMBL29961547 | 0.71 | RAPGEF4 (0.61) | IDO1RAPGEF4EGFRTDO2ALDH1A1 | |
| SCHEMBL1687027 | 0.71 | RAPGEF4 (0.61) | IDO1RAPGEF4EGFRTDO2ALDH1A1 | |
| SCHEMBL29961149 | 0.71 | RAPGEF4 (0.61) | IDO1RAPGEF4EGFRTDO2ALDH1A1 | |
| SCHEMBL7520380 | 0.70 | MT-CO2 (0.51) | IDO1ALDH1A1GAA | |
| SCHEMBL7524238 | 0.70 | RAPGEF4 (0.46) | RAPGEF4ALDH1A1GAA |
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-1173420-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | Novuspharma S.p.A. (IT) | 2002-01-23 | — | — | EP | disclosed |
| WO-2000053581-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | NOVUSPHARMA S.P.A. (IT) | 2000-09-14 | — | — | WO | disclosed |