Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL709424 | 0.82 | — | — | |
| SCHEMBL15519230 | 0.80 | CA2 (0.30) | — | |
| Pyridine SCHEMBL18764261 | 0.79 | TSHR (0.31) | TSHRNAPRTTDP1 | |
| Diallylsulfone SCHEMBL19837836 | 0.78 | TSHR (0.41) | TSHRNAPRTTDP1KDM4EALDH1A1 | |
| Imidazole SCHEMBL29033343 | 0.76 | ALDH1A1 (0.42) | ALDH1A1 | |
| Pyridine SCHEMBL915927 | 0.75 | NAPRT (0.38) | TSHRNAPRTTDP1KDM4EALDH1A1 | |
| Pyridine SCHEMBL28195350 | 0.73 | NAPRT (0.36) | TSHRNAPRTTDP1KDM4EALDH1A1 | |
| SCHEMBL5575427 | 0.68 | CA2 (0.31) | — | |
| SCHEMBL11097654 | 0.68 | — | — | |
| Pyridine SCHEMBL2541032 | 0.67 | SNCA (0.33) | TSHRNAPRTTDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805028-B | Method for removing trace aldehyde impurities in 1, 3-propylene glycol | 万华化学集团股份有限公司 | 2023-07-14 | — | — | CN | disclosed |