Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | ACHE | P22303 | 11/20 | 0.45 |
| ▸ | BCHE | P06276 | 10/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.43 |
| ▸ | TTPA | P49638 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9257317 | 0.87 | PTGS1 (0.54) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL9314920 | 0.86 | TTPA (0.58) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL15820288 | 0.80 | PTGS1 (0.74) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL18934019 | 0.80 | PTGS1 (0.74) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL15821003 | 0.80 | PTGS1 (0.74) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL15820289 | 0.80 | PTGS1 (0.74) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL1928208 | 0.80 | PTGS1 (0.78) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL8270579 | 0.80 | PTGS1 (0.78) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL16247633 | 0.80 | PTGS1 (0.78) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL7838636 | 0.79 | PTGS1 (0.67) | PTGS1PTGS2CYP1A2CYP3A4TSHR |
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-5315017-A | Peroxidation and eicosanoid biosynthesis inhibition | ADIR ET COMPAGNIE (FR) | 1994-05-24 | — | — | US | disclosed |
| EP-0512899-A1 | Benzopyran compounds, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1992-11-11 | — | — | EP | disclosed |