Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.53 |
| ▸ | TGM2 | P21980 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 8/20 | 0.45 |
| ▸ | MAOB | P27338 | 8/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4444879 | 0.83 | TGM2 (0.55) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL5330038 | 0.79 | TGM2 (0.53) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL11081844 | 0.76 | MAOA (0.47) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL1767901 | 0.76 | TGM2 (0.50) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL1768067 | 0.74 | TGM2 (0.47) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL4967546 | 0.73 | ALDH1A1 (0.55) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL28045892 | 0.72 | MAOA (0.58) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL9114249 | 0.72 | TGM2 (0.45) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL29657257 | 0.71 | ROS1 (0.67) | CES1TGM2ALDH1A1MAOAMAOB | |
| SCHEMBL281743 | 0.71 | ROS1 (0.67) | CES1TGM2ALDH1A1MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2970183-A2 | ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS | Musc Foundation for Research Development (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014160143-A2 | ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS | MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) | 2014-10-02 | — | — | WO | disclosed |