Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 8/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 5/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | BRD7 | Q9NPI1 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.33 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2952197 | 0.74 | ALDH1A1 (0.53) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP2E1 | |
| SCHEMBL27316793 | 0.74 | BRD4 (0.66) | BRD4CYP1A1CYP1B1CYP1A2CYP2E1 | |
| SCHEMBL12641962 | 0.74 | BRD4 (0.43) | ALDH1A1BRD4BRD9ATMCYP2A6 | |
| SCHEMBL27316789 | 0.72 | BRD4 (0.35) | BRD4BRD9BRD2BRD7RXRA | |
| SCHEMBL27316787 | 0.71 | HSD17B1 (0.41) | ALDH1A1BRD4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL16271028 | 0.68 | — | — | |
| SCHEMBL31585892 | 0.68 | BRD4 (0.58) | ALDH1A1BRD4BRD9ATM | |
| SCHEMBL16140269 | 0.66 | ALDH1A1 (0.48) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP2E1 | |
| SCHEMBL29951799 | 0.65 | ALDH1A1 (0.50) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP2A6 | |
| SCHEMBL5883049 | 0.65 | ALDH1A1 (0.50) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP2A6 |
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-2024057020-A1 | ANTI-VIRAL COMPOUNDS | Infex Therapeutics Limited (GB) | 2024-03-21 | — | — | WO | disclosed |