Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HAT1 | O14929 | 1/20 | 0.36 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6672645 | 0.87 | HSP90AA1 (0.42) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6667497 | 0.85 | HSP90AA1 (0.41) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL7014636 | 0.83 | RAB9A (0.38) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL7483549 | 0.81 | HSP90AA1 (0.44) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6283777 | 0.81 | MEN1 (0.47) | RAB9AHAT1EP300MEN1GAA | |
| SCHEMBL7475445 | 0.78 | HSP90AA1 (0.44) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6670849 | 0.78 | NR1H4 (0.41) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6672009 | 0.76 | HSP90AA1 (0.39) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6672671 | 0.76 | NR1H4 (0.40) | HSP90AA1NR1H4NPC1RAB9AHAT1 | |
| SCHEMBL6671405 | 0.76 | HSP90AA1 (0.40) | HSP90AA1NR1H4NPC1RAB9AHAT1 |
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-1301493-A2 | HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2003-04-16 | — | — | EP | disclosed |
| WO-2002004444-A2 | HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2002-01-17 | — | — | WO | disclosed |