Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CMA1 | P23946 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18496 | 0.75 | ALDH1A1 (0.40) | ALDH1A1PKMGAAL3MBTL1PTGES2 | |
| SCHEMBL15529701 | 0.74 | EPHX2 (0.36) | ALDH1A1MAPTNPSR1KMT2ACYP1A2 | |
| SCHEMBL18484 | 0.72 | CA2 (0.38) | ALDH1A1CMA1MEN1KMT2A | |
| SCHEMBL23664427 | 0.68 | PKM (0.44) | ALDH1A1PKMGAAL3MBTL1NPC1 | |
| SCHEMBL18577 | 0.68 | IDH1 (0.39) | ALDH1A1NPC1POLBRAB9ACMA1 | |
| SCHEMBL3436871 | 0.67 | PKM (0.45) | ALDH1A1PKMGAANPC1RAB9A | |
| SCHEMBL13471700 | 0.67 | ALDH1A1 (0.60) | ALDH1A1PKMGAAL3MBTL1PTGES2 | |
| SCHEMBL13098073 | 0.66 | TP53 (0.59) | ALDH1A1L3MBTL1NPC1POLBMAPT | |
| SCHEMBL2569391 | 0.66 | ALDH1A1 (0.59) | ALDH1A1PKMGAAL3MBTL1PTGES2 | |
| SCHEMBL17895138 | 0.65 | PKM (0.44) | ALDH1A1PKMGAAL3MBTL1PTGES2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012025460-A1 | OXADIAZOLINONE DERIVATIVES AND USE THEREOF IN PEST CONTROL | BAYER CROPSCIENCE AG (DE) | 2012-03-01 | — | — | WO | disclosed |