Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 6/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.35 |
| ▸ | CBFB | Q13951 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 5/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL23458436 | 0.99 | RAB9A (0.38) | RAB9ANPC1HPGDSMN1; SMN2PKM | |
| SCHEMBL23486246 | 0.87 | S1PR1 (0.37) | RAB9ANPC1HPGDSMN1; SMN2NFKB1 | |
| SCHEMBL23458511 | 0.85 | S1PR1 (0.33) | MAPT | |
| Trifluoroacetic Acid SCHEMBL23458508 | 0.80 | S1PR1 (0.38) | TP53MAPTLMNATHRB | |
| SCHEMBL22322458 | 0.73 | ALDH1A1 (0.35) | RAB9ANPC1HPGDSMN1; SMN2PKM | |
| SCHEMBL23486113 | 0.72 | DYRK1A (0.35) | KDM4EALDH1A1DYRK1A | |
| Bromide SCHEMBL23458489 | 0.71 | DYRK1A (0.34) | DYRK1A | |
| SCHEMBL11242321 | 0.71 | ALDH1A1 (0.48) | RAB9ANPC1HPGDSMN1; SMN2TP53 | |
| SCHEMBL22340702 | 0.70 | CYP2D6 (0.43) | SMN1; SMN2ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL23486248 | 0.70 | TP53 (0.49) | RAB9ANPC1HPGDSMN1; SMN2PKM |
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-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |