Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.73 |
| ▸ | PKM | P14618 | 2/20 | 0.73 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL4926038 | 0.86 | ALDH1A1 (0.55) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL13791613 | 0.84 | ALDH1A1 (0.54) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4923028 | 0.83 | ALDH1A1 (0.50) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4928786 | 0.82 | ALDH1A1 (0.52) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4924642 | 0.82 | ALDH1A1 (0.52) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4928078 | 0.82 | ALDH1A1 (0.49) | ALDH1A1PKMMAPTLMNAKDM4E | |
| Hydrochloric Acid SCHEMBL4930234 | 0.82 | ALDH1A1 (0.49) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4924612 | 0.81 | ALDH1A1 (0.51) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL4918991 | 0.81 | ALDH1A1 (0.51) | ALDH1A1PKMMAPTLMNAKDM4E | |
| SCHEMBL7036441 | 0.81 | MEN1 (0.64) | ALDH1A1PKMMAPTLMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6143773-A | Substituted thienobenzisoxazole derivatives for enhancing cognition | MERCK SHARP & DOHME LIMITED (GB) | 2000-11-07 | — | — | US | disclosed |