Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL394937 | 0.82 | PNMT (0.38) | PNMTNPC1RAB9APGR | |
| Hydrochloric Acid SCHEMBL5909845 | 0.71 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL4465758 | 0.70 | PNMT (0.38) | PNMTNPC1RAB9A | |
| SCHEMBL7754800 | 0.69 | PNMT (0.50) | PNMTNPC1RAB9APGR | |
| SCHEMBL7209740 | 0.68 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL28332079 | 0.68 | PNMT (0.49) | PNMTNPC1RAB9APGR | |
| Hydrochloric Acid SCHEMBL7780981 | 0.68 | PNMT (0.49) | PNMTNPC1RAB9APGR | |
| Hydrochloric Acid SCHEMBL396688 | 0.68 | PNMT (0.49) | PNMTNPC1RAB9APGR | |
| Hydrochloric Acid SCHEMBL394715 | 0.67 | PNMT (0.35) | PNMTNPC1RAB9A | |
| SCHEMBL7751995 | 0.66 | PNMT (0.47) | PNMTNPC1RAB9APGR |
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-1448568-A4 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | EXXONMOBIL CHEM PATENTS INC (US) | 2008-02-13 | — | — | EP | disclosed |
| EP-1448568-A2 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | ExxonMobil Chemical Patents Inc. (US) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003040070-A2 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2003-05-15 | — | — | WO | disclosed |