Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 6/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8840390 | 0.84 | NPC1 (0.37) | NPC1RAB9ABCHE | |
| SCHEMBL8840607 | 0.84 | MAPT (0.36) | NPC1RAB9ABCHEALDH1A1PKM | |
| SCHEMBL8708906 | 0.82 | NPC1 (0.37) | NPC1RAB9ABCHE | |
| SCHEMBL8840398 | 0.77 | HTR1A (0.35) | NPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL8416182 | 0.76 | NPC1 (0.39) | NPC1RAB9ABCHEL3MBTL1 | |
| SCHEMBL8840549 | 0.75 | ALDH1A1 (0.37) | ALOX15BCHEALOX5ALDH1A1 | |
| SCHEMBL8840429 | 0.75 | HTR1A (0.33) | ALDH1A1 | |
| SCHEMBL8840436 | 0.75 | HTR1A (0.33) | ALDH1A1 | |
| SCHEMBL8840570 | 0.70 | FGFR2 (0.37) | ALDH1A1L3MBTL1 | |
| SCHEMBL8840573 | 0.70 | FGFR2 (0.37) | ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5650417-A | Substituted pyridines, their preparation, and their use as pesticides and fungicides | HOECHST SCHERING AGREVO GMBH (DE) | 1997-07-22 | — | — | US | disclosed |
| EP-0719255-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | Hoechst Schering AgrEvo GmbH (DE) | 1996-07-03 | — | — | EP | disclosed |
| WO-1995007890-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | HOECHST SCHERING AGREVO GMBH (DE) | 1995-03-23 | — | — | WO | disclosed |