Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 2/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 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 | |
|---|---|---|---|---|
| SCHEMBL11661653 | 0.86 | TRPA1 (0.44) | TRPA1ALOX15IGF1RPOLBUSP2 | |
| SCHEMBL5988961 | 0.86 | TRPA1 (0.47) | TRPA1ALOX15IGF1RPOLBBACE1 | |
| SCHEMBL5988956 | 0.86 | TRPA1 (0.47) | TRPA1ALOX15IGF1RPOLBBACE1 | |
| SCHEMBL5988966 | 0.86 | TRPA1 (0.47) | TRPA1ALOX15IGF1RPOLBBACE1 | |
| SCHEMBL11759062 | 0.83 | TRPA1 (0.45) | TRPA1ALOX15IGF1RKDM4EALDH1A1 | |
| SCHEMBL11758521 | 0.77 | ESR1 (0.38) | ALOX15ESR1ESR2ALDH1A1MAPT | |
| SCHEMBL11664402 | 0.76 | MEN1 (0.37) | TRPA1ALOX15IGF1RKDM4EALDH1A1 | |
| SCHEMBL9296266 | 0.72 | TRPA1 (0.52) | TRPA1ALOX15KDM4EALDH1A1GAA | |
| SCHEMBL11194552 | 0.70 | TRPA1 (0.43) | TRPA1ALOX15POLBBACE1KDM4E | |
| SCHEMBL775290 | 0.69 | TP53 (0.43) | TRPA1ALDH1A1TP53TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4122194-A | Aryl sulphur compounds as antiasthmatics | LILLY INDUSTRIES LIMITED (GB) | 1978-10-24 | — | — | US | claimed |
| US-4122194-A | Aryl sulphur compounds as antiasthmatics | LILLY INDUSTRIES LIMITED (GB) | 1978-10-24 | — | — | US | disclosed |