Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 9/20 | 0.59 |
| ▸ | MAPK7 | Q13164 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL17607058 | 0.88 | MAPK14 (0.67) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL300049 | 0.84 | POLB (0.68) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL29191087 | 0.83 | MAPK14 (0.57) | MAPK14MAPK7POLBALDH1A1GAA | |
| SCHEMBL17607070 | 0.78 | MAPK7 (0.63) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL17607056 | 0.78 | POLB (0.60) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL31114409 | 0.78 | MAPK7 (0.63) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL298049 | 0.78 | KMT2A (0.71) | MAPK14POLBALDH1A1PKML3MBTL1 | |
| SCHEMBL10756348 | 0.77 | CDC25B (0.55) | MAPK14POLBALDH1A1PKML3MBTL1 | |
| SCHEMBL4827330 | 0.76 | RAB9A (0.59) | MAPK14MAPK7POLBALDH1A1PKM | |
| SCHEMBL5038336 | 0.76 | GAA (0.49) | MAPK14MAPK7ALDH1A1RAB9ACES2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117886734-A | Heterocyclic amide compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2024-04-16 | — | — | CN | disclosed |
| EP-2300485-A1 | PYRROLO Ý2, 3-C¨PYRIDINE DERIVATIVES AS P38 KINASE INHIBITING AGENTS | Merck Sharp & Dohme Corp. (US) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009152072-A1 | PYRROLO [2, 3-C] PYRIDINE DERIVATIVES AS P38 KINASE INHIBITING AGENTS | MERCK & CO., INC. (US) | 2009-12-17 | — | — | WO | disclosed |