Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18389643 | 0.77 | ALDH1A1 (0.39) | ALDH1A1AOC3TAAR1MAOAATM | |
| SCHEMBL28914812 | 0.76 | ALDH1A1 (0.35) | SIGMAR1ALDH1A1AOC3TAAR1ATM | |
| SCHEMBL338863 | 0.71 | ALDH1A1 (0.41) | ALDH1A1AOC3TAAR1MAOAATM | |
| SCHEMBL837631 | 0.71 | ALDH1A1 (0.41) | ALDH1A1AOC3TAAR1ATMCYP2A6 | |
| SCHEMBL1325408 | 0.69 | MAOA (0.43) | SIGMAR1ALDH1A1AOC3TAAR1SLC6A2 | |
| SCHEMBL3342114 | 0.68 | TP53 (0.39) | SIGMAR1ALDH1A1AOC3TAAR1SLC6A2 | |
| SCHEMBL17519998 | 0.67 | ALDH1A1 (0.37) | SIGMAR1ALDH1A1AOC3TAAR1ATM | |
| SCHEMBL7749434 | 0.66 | ALDH1A1 (0.48) | ALDH1A1AOC3TAAR1MAOAATM | |
| SCHEMBL476138 | 0.66 | TP53 (0.50) | ALDH1A1AOC3TAAR1MAOAATM | |
| SCHEMBL3482599 | 0.66 | IDO1 (0.37) | SIGMAR1ALDH1A1AOC3TAAR1SLC6A2 |
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-3323505-B1 | HYDROSILYLATION REACTION CATALYST | UNIV KYUSHU NAT UNIV CORP (JP) | 2024-07-17 | — | — | EP | disclosed |