Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.50 |
| ▸ | ABAT | P80404 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 3/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22566480 | 0.87 | THRB (0.49) | HSD17B10PARP10F2PRSS1PRSS2 | |
| SCHEMBL22566606 | 0.87 | THRB (0.49) | HSD17B10PARP10F2PRSS1PRSS2 | |
| SCHEMBL15695635 | 0.87 | THRB (0.49) | HSD17B10PARP10F2PRSS1PRSS2 | |
| SCHEMBL21470125 | 0.87 | THRB (0.49) | HSD17B10PARP10F2PRSS1PRSS2 | |
| SCHEMBL14192394 | 0.86 | MAPT (0.48) | ALDH5A1ABATHSD17B10AKT1PARP10 | |
| SCHEMBL14192452 | 0.86 | THRB (0.68) | PRSS1KMT2AMAPTMEN1SMN1; SMN2 | |
| SCHEMBL14192518 | 0.86 | THRB (0.68) | PRSS1KMT2AMAPTMEN1SMN1; SMN2 | |
| SCHEMBL25118429 | 0.86 | AKT1 (0.62) | ALDH5A1ABATHSD17B10AKT1PARP10 | |
| SCHEMBL14192470 | 0.85 | ALDH5A1 (0.46) | ALDH5A1ABATHSD17B10AKT1PARP10 | |
| SCHEMBL14192469 | 0.85 | ALDH5A1 (0.46) | ALDH5A1ABATHSD17B10AKT1PARP10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |