Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6163719 | 0.87 | NPSR1 (0.35) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6163715 | 0.87 | NPSR1 (0.35) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6163911 | 0.86 | MAPT (0.42) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6183768 | 0.86 | ALDH1A1 (0.38) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6164597 | 0.84 | NPC1 (0.36) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6166222 | 0.83 | KMT2A (0.39) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6166932 | 0.82 | RAB9A (0.36) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6164872 | 0.82 | ALDH1A1 (0.35) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6166432 | 0.82 | TP53 (0.35) | ALDH1A1MAPK1MEN1KMT2ANPSR1 | |
| SCHEMBL6162645 | 0.82 | LMNA (0.41) | ALDH1A1MAPK1MEN1KMT2ANPSR1 |
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-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| EP-1177185-A1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.p.A. (IT) | 2002-02-06 | — | — | EP | disclosed |
| WO-2000069846-A1 | 4,5,6,7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.P.A. (IT) | 2000-11-23 | — | — | WO | disclosed |