Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL10495330 | 0.78 | TRPA1 (0.32) | TRPA1HSP90AA1HSP90AB1KDM4EALDH1A1 | |
| SCHEMBL858277 | 0.78 | TRPA1 (0.48) | TRPA1KDM4EALDH1A1GLAGAA | |
| SCHEMBL30026897 | 0.78 | TRPA1 (0.48) | TRPA1KDM4EALDH1A1GLAGAA | |
| SCHEMBL3372535 | 0.72 | — | — | |
| SCHEMBL3807658 | 0.71 | TRPA1 (0.40) | TRPA1ESR1ESR2CYP1A2 | |
| SCHEMBL705441 | 0.67 | GABRA1 (0.42) | TRPA1HSP90AA1HSP90AB1PRKCIESR1 | |
| SCHEMBL21981883 | 0.67 | ESR1 (0.40) | TRPA1KDM4EALDH1A1TDP1MAPK1 | |
| Sulfuric Acid SCHEMBL28985287 | 0.67 | HSD17B10 (0.40) | TRPA1KDM4EALDH1A1THRBRECQL | |
| SCHEMBL25328734 | 0.67 | MAOB (0.43) | HSP90AA1HSP90AB1KDM4EALDH1A1MAPT | |
| SCHEMBL2065679 | 0.66 | TRPA1 (0.48) | TRPA1ALDH1A1TDP1RECQLHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4847001-A | DIHYDROXYBENZENE SULFONIC ACIDS AND SALTS | W. R. GRACE & CO.-CONN. (US) | 1989-07-11 | — | — | US | disclosed |