Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29018722 | 0.85 | ALDH1A1 (0.44) | NPC1RAB9AALDH1A1MAPTCYP1A2 | |
| SCHEMBL28440302 | 0.83 | NPC1 (0.62) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL6858071 | 0.81 | CYP1A2 (0.56) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL28440293 | 0.79 | POLB (0.56) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL6859262 | 0.77 | CYP1A2 (0.64) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL28434645 | 0.77 | NAPRT (0.52) | NPC1RAB9APKMALDH1A1MAPT | |
| SCHEMBL13741360 | 0.76 | CYP1A2 (0.50) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL7779068 | 0.75 | CYP1A2 (0.53) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL11786602 | 0.75 | ALDH1A1 (0.53) | NPC1RAB9APKMALDH1A1HTT | |
| SCHEMBL8830517 | 0.74 | SMN1; SMN2 (0.73) | NPC1RAB9AALDH1A1HTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-111533707-B | Preparation method of polysubstituted oxazole-2 (3H) -ketone compound | 中国科学院长春应用化学研究所 | 2022-07-15 | — | — | CN | disclosed |
| CN-111533707-A | Preparation method of polysubstituted oxazole-2 (3H) -ketone compound | 中国科学院长春应用化学研究所 | 2020-08-14 | — | — | CN | disclosed |