Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASAH1 | Q13510 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.62 |
| ▸ | CERT1 | Q9Y5P4 | 3/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | SMPD2 | O60906 | 2/20 | 0.52 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.52 |
| ▸ | UGCG | Q16739 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL31043494 | 0.89 | ASAH1 (0.63) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL31043495 | 0.89 | ASAH1 (0.63) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL13963519 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL31043498 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL31043501 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL14842112 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL14842114 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL4786264 | 0.88 | ASAH1 (0.66) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL13271749 | 0.87 | ASAH1 (0.47) | ASAH1ALDH1A1ACER2CERT1NPSR1 | |
| SCHEMBL2628429 | 0.85 | ASAH1 (0.46) | ASAH1ALDH1A1ACER2CERT1NPSR1 |
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-4596816-A | Pharmaceuticals | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-06-24 | — | — | US | disclosed |
| EP-0092239-A2 | Oxazole derivatives, production and use thereof | Takeda Chemical Industries, Ltd. (JP) | 1983-10-26 | — | — | EP | disclosed |