Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GBA1 | P04062 | 1/20 | 0.47 |
| ▸ | UGCG | Q16739 | 1/20 | 0.47 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7381201 | 0.99 | ALDH1A1 (0.49) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL7391078 | 0.93 | GBA1 (0.47) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL7387138 | 0.91 | GBA1 (0.45) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11775725 | 0.79 | CYP3A4 (0.50) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11775290 | 0.79 | CYP3A4 (0.50) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11775440 | 0.78 | CYP3A4 (0.49) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11772170 | 0.78 | CYP3A4 (0.49) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11780707 | 0.78 | CYP3A4 (0.52) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11778312 | 0.78 | CYP3A4 (0.52) | ALDH1A1GBA1UGCGGBA2TSHR | |
| SCHEMBL11773523 | 0.78 | CYP3A4 (0.52) | ALDH1A1GBA1UGCGGBA2TSHR |
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-5864039-A | THERAPEUTIC TREATMENT OF VARIOUS GASTROINTESTINAL DISEASES, CENTRAL NERVOUS DISORDERS, CARDIOVASCULAR DISORDERS, URINARY DISEASES, UROGENITAL DISORDERS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1999-01-26 | — | — | US | disclosed |
| EP-0873990-A1 | BENZOIC ACID COMPOUNDS AND MEDICINAL USE THEREOF | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1998-10-28 | — | — | EP | disclosed |