Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28185540 | 0.78 | NPC1 (0.40) | ALDH1A1TDP1L3MBTL1MAPK1MEN1 | |
| SCHEMBL28853237 | 0.78 | ALDH1A1 (0.40) | ALDH1A1TDP1L3MBTL1MAPK1MEN1 | |
| SCHEMBL2711475 | 0.75 | ALDH1A1 (0.58) | ALDH1A1TDP1L3MBTL1RXFP1MAPK1 | |
| SCHEMBL6425266 | 0.75 | ALDH1A1 (0.72) | ALDH1A1TDP1L3MBTL1S1PR1MAPK1 | |
| SCHEMBL28186243 | 0.74 | EIF4E (0.38) | ALDH1A1TDP1L3MBTL1POLB | |
| SCHEMBL28186237 | 0.74 | ALDH1A1 (0.46) | ALDH1A1TDP1L3MBTL1NPC1RAB9A | |
| SCHEMBL7918730 | 0.73 | ABCC1 (0.49) | ALDH1A1TDP1MEN1KMT2ANPC1 | |
| SCHEMBL2711808 | 0.72 | ALDH1A1 (0.50) | ALDH1A1TDP1L3MBTL1S1PR1RXFP1 | |
| SCHEMBL28185537 | 0.72 | NPC1 (0.53) | ALDH1A1TDP1PIN1MEN1KMT2A | |
| SCHEMBL6451539 | 0.71 | NPC1 (0.65) | ALDH1A1TDP1L3MBTL1KMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107382892-A | A kind of preparation technology of the nitro isoxazole compound of 3 aryl 4 | 贵州大学 | 2017-11-24 | — | — | CN | disclosed |