Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13397617 | 1.00 | ALDH1A1 (0.32) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL9149805 | 0.79 | — | — | |
| SCHEMBL15331262 | 0.76 | — | — | |
| SCHEMBL7012640 | 0.74 | CHEK1 (0.35) | ALDH1A1HPGD | |
| SCHEMBL31547297 | 0.72 | — | — | |
| SCHEMBL14536340 | 0.71 | — | — | |
| SCHEMBL18663893 | 0.70 | — | — | |
| SCHEMBL14139043 | 0.64 | ALDH1A1 (0.32) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL10134052 | 0.64 | ALDH1A1 (0.31) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL12081656 | 0.64 | ALDH1A1 (0.31) | ALDH1A1HPGDHSD17B10 |
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-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| US-5753664-A | ANTITUMOR AGENTS, PYRIMIDONES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |