Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | NR1I3 | Q14994 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPY2R | P49146 | 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 | |
|---|---|---|---|---|
| SCHEMBL6675178 | 0.85 | KDM4E (0.44) | ALDH1A1GAANR1I3KMT2AMAPK1 | |
| SCHEMBL6678474 | 0.84 | ALDH1A1 (0.39) | ALDH1A1GAAKMT2ACYP1A2MAPT | |
| SCHEMBL6675695 | 0.84 | ALDH1A1 (0.39) | ALDH1A1GAAKMT2ACYP1A2MAPT | |
| SCHEMBL6675941 | 0.84 | KDM4E (0.43) | ALDH1A1GAANR1I3KMT2ACYP1A2 | |
| SCHEMBL6681804 | 0.83 | GRM2 (0.38) | ALDH1A1GAAKMT2ACYP1A2MAPT | |
| SCHEMBL6678436 | 0.83 | ALDH1A1 (0.40) | ALDH1A1GAAKMT2ANPC1 | |
| SCHEMBL6676380 | 0.82 | ALDH1A1 (0.37) | ALDH1A1GAAKMT2ACYP1A2MAPT | |
| SCHEMBL6682248 | 0.82 | ALDH1A1 (0.40) | ALDH1A1GAAKMT2ACYP1A2MAPT | |
| SCHEMBL6679793 | 0.82 | ALDH1A1 (0.35) | ALDH1A1GAANR1I3KMT2ACYP1A2 | |
| SCHEMBL7742143 | 0.82 | NR1I3 (0.33) | ALDH1A1GAANR1I3KMT2AMAPK1 |
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-6414005-B1 | BRAIN DISORDERS; ALZHEIMER'S DISEASE; PARKINSON'S DISEASE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2002-07-02 | — | — | US | disclosed |
| EP-1043312-A1 | HETEROCYCLIC COMPOUNDS HAVING NOS INHIBITORY ACTIVITIES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2000-10-11 | — | — | EP | disclosed |