Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 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 | |
|---|---|---|---|---|
| SCHEMBL9518131 | 0.85 | AOC3 (0.39) | ALDH1A1AOC3HRH3KMT2AMAPT | |
| SCHEMBL9519545 | 0.85 | AOC3 (0.39) | ALDH1A1F2GLAHPGDAOC3 | |
| SCHEMBL9515539 | 0.84 | KMT2A (0.37) | ALDH1A1F2GLAHPGDP4HTM | |
| SCHEMBL9319775 | 0.80 | PDE10A (0.39) | ALDH1A1F2GLAHPGDKMT2A | |
| SCHEMBL9319319 | 0.79 | P4HTM (0.35) | ALDH1A1F2GLAHPGDP4HTM | |
| SCHEMBL9515811 | 0.79 | P4HTM (0.35) | ALDH1A1F2GLAHPGDP4HTM | |
| SCHEMBL10817490 | 0.79 | GABRP (0.40) | ALDH1A1HPGDP4HTMFFAR1KMT2A | |
| SCHEMBL9519559 | 0.78 | P4HTM (0.49) | P4HTMFFAR1KMT2APPARGPPARA | |
| SCHEMBL19432655 | 0.78 | MBOAT4 (0.43) | ALDH1A1HPGDKMT2APIK3CDPIK3CA | |
| SCHEMBL9566775 | 0.78 | SMN1; SMN2 (0.51) | NPC1RAB9ASMN1; SMN2LMNACD274 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0533130-A1 | 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-03-24 | — | — | EP | disclosed |