Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5951211 | 1.00 | TRPA1 (0.44) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL25077559 | 0.83 | ESR2 (0.44) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL4930118 | 0.81 | TP53 (0.40) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL30972746 | 0.79 | TRPA1 (0.44) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL2168487 | 0.79 | TRPA1 (0.44) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL28562792 | 0.79 | KDM4E (0.46) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL10753626 | 0.77 | NCEH1 (0.42) | TRPA1ATMALDH1A1TSHRCYP1A2 | |
| SCHEMBL22363080 | 0.75 | TSHR (0.43) | TRPA1KDM4EALDH1A1GAAESR2 | |
| SCHEMBL23226962 | 0.75 | CYP3A4 (0.42) | TRPA1ATMKDM4EALDH1A1GAA | |
| SCHEMBL30388902 | 0.75 | TRPA1 (0.57) | TRPA1ATMKDM4EALDH1A1ESR2 |
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-118566412-A | Method for detecting acidity of water sample | 河南荣佳钪钒科技有限公司 | 2024-08-30 | — | — | CN | disclosed |