Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPYD | Q12882 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL11865099 | 0.81 | ACHE (0.35) | ACHEGDAALDH1A1 | |
| SCHEMBL4502299 | 0.64 | — | — | |
| Cyanate SCHEMBL7896406 | 0.55 | GSK3A (0.65) | — | |
| Cyanate SCHEMBL2195022 | 0.55 | GSK3A (0.65) | — | |
| Cyanate SCHEMBL8404267 | 0.55 | GSK3A (0.65) | — | |
| Water SCHEMBL7070154 | 0.54 | IDH1 (0.41) | DPYDGDAALDH1A1GAA | |
| Cyanate SCHEMBL9448677 | 0.53 | GSK3A (0.61) | — | |
| Water SCHEMBL27941642 | 0.52 | IDH1 (0.39) | DPYDGDAALDH1A1GAA | |
| Water SCHEMBL28511111 | 0.52 | IDH1 (0.39) | DPYDGDAALDH1A1GAA | |
| Water SCHEMBL28334606 | 0.52 | IDH1 (0.39) | DPYDGDAALDH1A1GAA |
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-3973947-A | 1,3,5-Triazinediones and their use as selective herbicides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-08-10 | — | — | US | disclosed |
| US-3951971-A | SELECTIVE HERBICIDES | FUCHS JULIUS JAKOB | 1976-04-20 | — | — | US | disclosed |