Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11612178 | 0.73 | ALDH1A1 (0.31) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| SCHEMBL8801099 | 0.66 | — | — | |
| SCHEMBL11604813 | 0.66 | CDK2 (0.34) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| SCHEMBL11605574 | 0.61 | — | — | |
| SCHEMBL11608385 | 0.61 | — | — | |
| SCHEMBL11607559 | 0.61 | — | — | |
| SCHEMBL9320305 | 0.61 | ALDH1A1 (0.36) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| SCHEMBL11610563 | 0.60 | ALDH1A1 (0.39) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| SCHEMBL11606146 | 0.59 | ALDH1A1 (0.33) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| SCHEMBL11608217 | 0.57 | ALDH1A1 (0.31) | ALDH1A1TP53HPGDTSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4101546-A | Cyanatothiomethylthio pyrazines | THE DOW CHEMICAL COMPANY (US) | 1978-07-18 | — | — | US | claimed |
| US-4101546-A | Cyanatothiomethylthio pyrazines | THE DOW CHEMICAL COMPANY (US) | 1978-07-18 | — | — | US | disclosed |