Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5953661 | 0.84 | IDO1 (0.47) | ALDH1A1 | |
| SCHEMBL13053842 | 0.82 | AGXT (0.48) | ALDH1A1 | |
| SCHEMBL4053548 | 0.80 | APP (0.43) | ALDH1A1TSHR | |
| SCHEMBL1450921 | 0.79 | TSHR (0.46) | ALDH1A1TSHR | |
| SCHEMBL13863253 | 0.77 | APP (0.49) | ALDH1A1TSHR | |
| SCHEMBL7706546 | 0.77 | TRPA1 (0.39) | TRPA1ALDH1A1TSHRCYP4F2CYP4A11 | |
| SCHEMBL13036816 | 0.76 | ALDH1A1 (0.39) | ALDH1A1TSHR | |
| SCHEMBL31124761 | 0.74 | CYP4F2 (0.33) | TRPA1ALDH1A1TSHRCYP4F2CYP4A11 | |
| SCHEMBL19982577 | 0.73 | TRPA1 (0.36) | TRPA1ALDH1A1TSHRCYP4F2CYP4A11 | |
| SCHEMBL12646388 | 0.73 | IDO1 (0.54) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-118339172-A | Phosphonic acid compounds and prodrugs thereof, preparation method and application thereof | 上海海和药物研究开发股份有限公司 | 2024-07-12 | — | — | CN | disclosed |
| WO-2023138637-A1 | PHOSPHONIC ACID COMPOUND AND PRODRUG THEREOF, AND PREPARATION METHODS FOR AND USES OF PHOSPHONIC ACID COMPOUND AND PRODRUG THEREOF | 上海海和药物研究开发股份有限公司 | 2023-07-27 | — | — | WO | disclosed |