Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HAT1 | O14929 | 1/20 | 0.34 |
| ▸ | EP300 | Q09472 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 3/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | AKT2 | P31751 | 1/20 | 0.32 |
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 | 0.85 | HSP90AA1 (0.42) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL7015761 | 0.84 | ALDH1A1 (0.41) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL7014028 | 0.83 | ALDH1A1 (0.37) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL7015592 | 0.83 | HSP90AA1 (0.40) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL6667497 | 0.83 | HSP90AA1 (0.41) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL7007040 | 0.81 | PDE1B (0.45) | RAB9ANR1H4NPC1F10ENPP2 | |
| SCHEMBL6670849 | 0.78 | NR1H4 (0.41) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL7483549 | 0.77 | HSP90AA1 (0.44) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL6672671 | 0.76 | NR1H4 (0.40) | RAB9AALDH1A1HTTHSP90AA1NR1H4 | |
| SCHEMBL6667531 | 0.73 | NR1H4 (0.34) | HSP90AA1NR1H4NPC1MAPK14 |
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 |