Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.36 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27534190 | 0.85 | PTGDR2 (0.36) | ALDH1A1SMN1; SMN2LMNAMAPTKMT2A | |
| SCHEMBL7734258 | 0.83 | TDO2 (0.35) | — | |
| SCHEMBL7742120 | 0.83 | ALDH1A1 (0.44) | ITGA4ITGB7GABRA1GABRG2GABRB3 | |
| SCHEMBL6681036 | 0.80 | ALDH1A1 (0.45) | ITGA4ITGB7ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL6680614 | 0.79 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2LMNAMAPTKMT2A | |
| SCHEMBL7740522 | 0.79 | NPSR1 (0.43) | ITGA4ITGB7GABRA1GABRG2GABRB3 | |
| SCHEMBL6681796 | 0.78 | ALDH1A1 (0.49) | ITGA4ITGB7ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL6675790 | 0.78 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNAMAPTKMT2A | |
| SCHEMBL6677398 | 0.78 | ITGA4 (0.43) | ITGA4ITGB7ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL7734182 | 0.78 | GRM2 (0.33) | ALDH1A1MAPTKMT2ACYP1A2CYP3A4 |
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 |