Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.39 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.39 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.39 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.39 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Propionaldehyde SCHEMBL27740723 | 0.97 | ALDH1A1 (0.45) | ALDH1A1MAPK1TDP1CYP3A4CYP2C9 | |
| Biphenyl SCHEMBL27273593 | 0.81 | ALDH1A1 (0.50) | ALDH1A1MAPK1TDP1CYP1A2CYP2A6 | |
| Acetaldehyde SCHEMBL895439 | 0.80 | — | — | |
| SCHEMBL4836730 | 0.79 | CYP3A4 (0.39) | TDP1CYP3A4CYP2C9CYP1A2CYP2C19 | |
| Propane SCHEMBL27948872 | 0.77 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP1A2CYP2C19CYP1A1 | |
| Propionaldehyde SCHEMBL4244592 | 0.77 | ALDH1A1 (0.60) | ALDH1A1MAPK1TDP1RXRARXRB | |
| Propane SCHEMBL27289276 | 0.77 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP1A2CYP2C19CYP1A1 | |
| Propane SCHEMBL27933229 | 0.77 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP1A2CYP2C19CYP1A1 | |
| SCHEMBL27798276 | 0.77 | MEN1 (0.46) | ALDH1A1CYP3A4CYP2C9CYP1A2CYP2C19 | |
| M-Xylene SCHEMBL28139324 | 0.77 | ACHE (0.60) | ALDH1A1MAPK1TDP1CYP3A4CYP2C9 |
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-8440065-B1 | Electrolyte composition, method, and improved apparatus for high speed tin-silver electroplating | TECHNIC, INC. (US) | 2013-05-14 | — | — | US | claimed |
| EP-1229012-A1 | PROCESS FOR PREPARING BETA-KETOESTER ACETAL | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) | 2002-08-07 | — | — | EP | disclosed |