Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.59 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.48 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4522253 | 0.89 | CYSLTR2 (0.64) | CYSLTR2PLA2G4BNPC1POLBCASP6 | |
| SCHEMBL13918523 | 0.88 | CYSLTR2 (0.65) | CYSLTR2SCN9APLA2G4BNPC1HPGD | |
| SCHEMBL4516413 | 0.88 | CYSLTR2 (0.56) | CYSLTR2PLA2G4BNPC1POLBCASP6 | |
| SCHEMBL5209887 | 0.88 | CYSLTR2 (0.56) | CYSLTR2SCN9APLA2G4BNPC1POLB | |
| SCHEMBL13918454 | 0.87 | CYSLTR2 (0.62) | CYSLTR2SCN9APLA2G4BNPC1POLB | |
| SCHEMBL4526773 | 0.87 | CYSLTR2 (0.64) | CYSLTR2PLA2G4BPOLBCASP6NR1H4 | |
| SCHEMBL13918482 | 0.86 | CYSLTR2 (0.55) | CYSLTR2SCN9APLA2G4BNPC1ALDH1A1 | |
| SCHEMBL13918475 | 0.86 | CYSLTR2 (0.61) | CYSLTR2SCN9APLA2G4BNPC1POLB | |
| SCHEMBL13918337 | 0.86 | CYSLTR2 (0.60) | CYSLTR2PLA2G4BNPC1POLBALDH1A1 | |
| SCHEMBL4532981 | 0.85 | CYSLTR2 (0.55) | CYSLTR2PLA2G4BPOLBCASP6NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1572628-A1 | ISOPHTALIC ACID DERIVATIVES | Bayer HealthCare AG (DE) | 2005-09-14 | — | — | EP | disclosed |
| WO-2004052839-A1 | ISOPHTALIC ACID DERIVATIVES | BAYER HEALTHCARE AG (DE) | 2004-06-24 | — | — | WO | disclosed |