Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9355660 | 0.83 | CYP3A4 (0.33) | CYP3A4ALDH1A1MAPTSRD5A1SRD5A2 | |
| SCHEMBL9360485 | 0.82 | LPAR1 (0.33) | CYP3A4ALDH1A1MAPTSRD5A1SRD5A2 | |
| SCHEMBL8855173 | 0.82 | CYP3A4 (0.31) | CYP3A4ALDH1A1MAPTSRD5A1SRD5A2 | |
| SCHEMBL8855255 | 0.78 | AKR1C3 (0.31) | CYP3A4ALDH1A1MAPT | |
| SCHEMBL8855272 | 0.74 | MAPT (0.37) | CYP3A4ALDH1A1MAPTSRD5A1SRD5A2 | |
| SCHEMBL29552237 | 0.73 | FDPS (0.35) | CYP3A4ALDH1A1MAPTSRD5A2AR | |
| SCHEMBL9359525 | 0.73 | FDPS (0.35) | CYP3A4ALDH1A1MAPTSRD5A2AR | |
| SCHEMBL8855147 | 0.72 | SRD5A1 (0.32) | SRD5A1SRD5A2 | |
| SCHEMBL8855199 | 0.70 | POLA1 (0.51) | CYP3A4ALDH1A1MAPTPIK3CAPIK3CG | |
| SCHEMBL9360356 | 0.69 | CYP3A4 (0.36) | CYP3A4ALDH1A1MAPTSRD5A2SMN1; SMN2 |
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 |