Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NPY1R | P25929 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPY2R | P49146 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14304258 | 0.88 | SIGMAR1 (0.34) | SIGMAR1ALDH1A1GAAMAPTALPG | |
| SCHEMBL14303134 | 0.88 | ALDH1A1 (0.48) | SIGMAR1ALDH1A1GAAMAPTALPG | |
| SCHEMBL14304765 | 0.85 | LMNA (0.45) | ALDH1A1GAAMAPTALPGALOX12 | |
| SCHEMBL14288546 | 0.82 | MEN1 (0.46) | ALDH1A1GAAMAPTALPGALOX12 | |
| SCHEMBL14288548 | 0.79 | NAAA (0.51) | SIGMAR1ALDH1A1GAAHTTNPSR1 | |
| SCHEMBL14288549 | 0.79 | NAAA (0.51) | SIGMAR1ALDH1A1GAAHTTNPSR1 | |
| SCHEMBL4585678 | 0.78 | GAA (0.50) | ALDH1A1GAAMAPTALPGALOX12 | |
| SCHEMBL29173725 | 0.72 | L3MBTL1 (0.37) | ALDH1A1GAAMAPTNPSR1LMNA | |
| SCHEMBL13922107 | 0.71 | TSHR (0.37) | ALDH1A1GAAMAPTALPGALOX12 | |
| SCHEMBL8723450 | 0.71 | MEN1 (0.53) | ALDH1A1GAAMAPTHTTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008003809-A1 | ANTITUMOUR COMPOUNDS | PHARMA MAR, S.A. (ES) | 2008-01-10 | — | — | WO | disclosed |