Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | APP | P05067 | 6/20 | 0.51 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL900790 | 0.85 | ALDH1A1 (0.56) | ALDH1A1APPGAAGLAMEN1 | |
| SCHEMBL28033417 | 0.84 | ALDH1A1 (0.49) | ALDH1A1APPGAAGLAMEN1 | |
| SCHEMBL4798607 | 0.84 | APP (0.58) | ALDH1A1APPTNKSTNKS2GAA | |
| SCHEMBL28033960 | 0.84 | ALDH1A1 (0.51) | ALDH1A1APPTNKSTNKS2PARP2 | |
| SCHEMBL8535704 | 0.84 | ALDH1A1 (0.60) | ALDH1A1APPTNKSTNKS2GAA | |
| SCHEMBL23761942 | 0.83 | APP (0.50) | ALDH1A1APPGAAGLAMEN1 | |
| SCHEMBL28033414 | 0.83 | ALDH1A1 (0.54) | ALDH1A1APPTNKSTNKS2GAA | |
| SCHEMBL28128281 | 0.81 | HSD17B10 (0.51) | APPGAAGLAMEN1KMT2A | |
| SCHEMBL3922398 | 0.80 | APP (0.48) | ALDH1A1APPTNKSTNKS2PARP2 | |
| SCHEMBL10030531 | 0.79 | APP (0.47) | ALDH1A1APPGAAGLAMEN1 |
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-114436971-A | Di (4- (benzoxazol-2-yl) phenyl) methylamine derivative and preparation method thereof | 陕西维世诺新材料有限公司 | 2022-05-06 | — | — | CN | disclosed |
| CN-104987350-A | Chiral alpha-amino phosphonate ester compounds having anti-virus activity and containing benzothiazole heterocycle, preparation and applications thereof | UNIV GUIZHOU | 2015-10-21 | — | — | CN | disclosed |