Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6220134 | 0.82 | CYP3A4 (0.46) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL6222140 | 0.79 | CYP3A4 (0.44) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL4269741 | 0.76 | CYP3A4 (0.47) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL701743 | 0.71 | CYP3A4 (0.48) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL420514 | 0.71 | CYP3A4 (0.48) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL13556581 | 0.70 | CYP3A4 (0.58) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL31115174 | 0.70 | CYP3A4 (0.52) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL31115173 | 0.70 | CYP3A4 (0.52) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL29351907 | 0.70 | CYP3A4 (0.58) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL48414 | 0.70 | CYP3A4 (0.58) | CYP3A4TRPA1ALDH1A1HPGDTDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0316734-B1 | FURAZANYL UREAS | BAYER AG (DE) | 1991-07-03 | — | — | EP | disclosed |