Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL615246 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TSHRTHRB | |
| SCHEMBL616137 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TSHRTHRB | |
| SCHEMBL6151557 | 0.70 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRB | |
| SCHEMBL25405879 | 0.69 | BTN3A1 (0.37) | ALDH1A1 | |
| SCHEMBL294026 | 0.69 | — | — | |
| SCHEMBL3492594 | 0.68 | KMT2A (0.36) | ALDH1A1TSHR | |
| SCHEMBL27077155 | 0.67 | — | — | |
| SCHEMBL2321095 | 0.66 | — | — | |
| SCHEMBL293806 | 0.66 | — | — | |
| SCHEMBL364301 | 0.66 | ALDH1A1 (0.46) | ALDH1A1TSHRTHRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2260032-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. du Pont de Nemours and Company (US) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009094445-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-07-30 | — | — | WO | disclosed |