Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FGF23 | Q9GZV9 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL191091 | 0.84 | CHAT (0.45) | NFE2L2RELAALOX5ALDH1A1 | |
| SCHEMBL191092 | 0.84 | CHAT (0.45) | NFE2L2RELAALOX5ALDH1A1 | |
| SCHEMBL339221 | 0.81 | — | — | |
| SCHEMBL5664436 | 0.81 | — | — | |
| SCHEMBL28245646 | 0.81 | NFE2L2 (0.57) | NFE2L2PTGS1 | |
| SCHEMBL2940302 | 0.81 | NFE2L2 (0.46) | NFE2L2ALOX5PTGS1PTGS2MAPT | |
| SCHEMBL2931689 | 0.80 | TRPA1 (0.61) | NFE2L2RELAALOX5PTGS1PTGS2 | |
| SCHEMBL20580084 | 0.77 | NFE2L2 (0.47) | FGF23NFE2L2 | |
| SCHEMBL28242387 | 0.77 | AHR (0.46) | NFE2L2PTGS1ALDH1A1CA1PTGES2 | |
| SCHEMBL28469899 | 0.74 | RELA (0.58) | RELAPTGS1MAPTALDH1A1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1978967-B1 | QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS | NOVARTIS AG (CH) | 2010-09-22 | — | — | EP | claimed |
| CN-111647018-B | Preparation method of phosphorus center chiral compound | 杭州师范大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-111647018-A | Preparation method of phosphorus center chiral compound | 杭州师范大学 | 2020-09-11 | — | — | CN | disclosed |
| EP-1978967-B1 | QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS | NOVARTIS AG (CH) | 2010-09-22 | — | — | EP | disclosed |