Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 6/20 | 0.57 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | SSTR2 | P30874 | 4/20 | 0.39 |
| ▸ | SSTR4 | P31391 | 4/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5237488 | 0.86 | GBA1 (0.60) | GBA1HRH3SSTR2SSTR4HCAR3 | |
| SCHEMBL2256335 | 0.85 | GBA1 (0.51) | GBA1HRH3SSTR2SSTR4HCAR3 | |
| SCHEMBL31217157 | 0.85 | GBA1 (0.56) | GBA1HCAR3AOC3NPC1RAB9A | |
| SCHEMBL9866571 | 0.81 | HRH3 (0.51) | GBA1HRH3HCAR3PKMAOC3 | |
| SCHEMBL1432671 | 0.81 | GBA1 (0.59) | GBA1HCAR3PKMAOC3NPC1 | |
| SCHEMBL21841697 | 0.81 | GBA1 (0.47) | GBA1RAD52SSTR2SSTR4HCAR3 | |
| SCHEMBL5255404 | 0.79 | GBA1 (0.53) | GBA1SSTR2SSTR4HCAR3NPC1 | |
| SCHEMBL1433090 | 0.77 | GBA1 (0.69) | GBA1HCAR3AOC3NPC1ALDH1A1 | |
| SCHEMBL5253357 | 0.77 | GBA1 (0.50) | GBA1HCAR3ALDH1A1EGFR | |
| SCHEMBL14484960 | 0.76 | HRH3 (0.47) | GBA1HRH3HCAR3ALDH1A1 |
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-0113572-B1 | PYRIDINE DERIVATIVES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1988-02-03 | — | — | EP | disclosed |
| US-4547506-A | 2-Pyridylaminoakylamino-4-pyrimidones useful as histamine H1 -antagonists | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1985-10-15 | — | — | US | disclosed |
| EP-0113572-A2 | Pyridine derivatives | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1984-07-18 | — | — | EP | disclosed |