Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.38 |
| ▸ | EP300 | Q09472 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.36 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4031919 | 0.85 | TRPA1 (0.50) | TRPA1S1PR4S1PR3EP300ALDH1A1 | |
| SCHEMBL4030341 | 0.84 | LPAR1 (0.39) | S1PR3ALDH1A1LPAR1LPAR3 | |
| SCHEMBL4036790 | 0.77 | TRPA1 (0.46) | TRPA1EP300ALDH1A1LPAR1LPAR3 | |
| SCHEMBL4033561 | 0.73 | LPAR1 (0.42) | TRPA1ALDH1A1LPAR1LPAR3 | |
| SCHEMBL4028121 | 0.73 | LPAR1 (0.44) | TRPA1ALDH1A1LPAR1LPAR3 | |
| SCHEMBL4030691 | 0.73 | LPAR1 (0.41) | LPAR1LPAR3 | |
| SCHEMBL4037774 | 0.73 | LPAR1 (0.33) | S1PR3LPAR1MLYCD | |
| SCHEMBL4035140 | 0.72 | KMT2A (0.44) | — | |
| SCHEMBL4031685 | 0.72 | LPAR1 (0.59) | TRPA1S1PR4S1PR3EP300ALDH1A1 | |
| SCHEMBL4036870 | 0.68 | MAPK1 (0.42) | ALDH1A1LPAR1LPAR3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1258484-B1 | NOVEL ISOXAZOLE AND THIAZOLE COMPOUNDS AND USE THEREOF AS DRUGS | KYOWA HAKKO KIRIN CO LTD (JP) | 2009-01-14 | — | — | EP | claimed |