Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | PLAU | P00749 | 2/20 | 0.47 |
| ▸ | F12 | P00748 | 1/20 | 0.47 |
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | NOS2 | P35228 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4066216 | 1.00 | CYP2A6 (0.52) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL27984264 | 0.90 | ATM (0.46) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL4067893 | 0.89 | CYP2A6 (0.48) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL31125170 | 0.89 | CYP2A6 (0.48) | CYP2A6ATMPLAUF12NCF1 | |
| Hydrochloric Acid SCHEMBL26126612 | 0.87 | CYP2A6 (0.47) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL2030595 | 0.87 | CYP2A6 (0.47) | CYP2A6ATMPLAUF12NCF1 | |
| Iodide SCHEMBL2453300 | 0.87 | CYP2A6 (0.47) | CYP2A6ATMPLAUF12NCF1 | |
| Bromide SCHEMBL6680136 | 0.87 | CYP2A6 (0.47) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL4060780 | 0.86 | CYP2A6 (0.46) | CYP2A6ATMPLAUF12NCF1 | |
| SCHEMBL4062603 | 0.86 | CYP2A6 (0.46) | CYP2A6ATMPLAUF12NCF1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4133047-A1 | CLEANING ARTICLE WITH PREFERENTIAL RHEOLOGICAL SOLID COMPOSITION | The Procter & Gamble Company (US) | 2023-02-15 | — | — | EP | disclosed |