Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL8855173 | 0.82 | CYP3A4 (0.31) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL9355660 | 0.79 | CYP3A4 (0.33) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL8855310 | 0.78 | CYP3A4 (0.33) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL9360485 | 0.77 | LPAR1 (0.33) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL9359525 | 0.70 | FDPS (0.35) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL29552237 | 0.70 | FDPS (0.35) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL8855272 | 0.69 | MAPT (0.37) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL9360356 | 0.67 | CYP3A4 (0.36) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL8855199 | 0.66 | POLA1 (0.51) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL8855332 | 0.64 | CYP3A4 (0.54) | ALDH1A1CYP3A4MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5654343-A | NITRIC OXIDE SYNTHESIS INHIBITOR; TREATING ENDOTOXIC SHOCK | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-08-05 | — | — | US | disclosed |
| EP-0676196-A1 | NITROGEN MONOXIDE SYNTHESIS INHIBITOR | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-10-11 | — | — | EP | disclosed |