Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.37 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | F12 | P00748 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL20594416 | 0.84 | TSHR (0.50) | TSHRNPSR1ALDH1A1MAPKAPK2GAA | |
| SCHEMBL7624347 | 0.74 | TBXAS1 (0.39) | TSHRNPSR1F12 | |
| SCHEMBL28404587 | 0.74 | GAA (0.33) | TSHRNPSR1ALDH1A1GAAMAPT | |
| SCHEMBL29381539 | 0.74 | TSHR (0.97) | TSHRNPSR1MAPKAPK2GAAMAPT | |
| SCHEMBL514422 | 0.74 | TSHR (0.97) | TSHRNPSR1MAPKAPK2GAAMAPT | |
| SCHEMBL29505877 | 0.74 | TSHR (0.97) | TSHRNPSR1MAPKAPK2GAAMAPT | |
| SCHEMBL574702 | 0.74 | TSHR (0.97) | TSHRNPSR1MAPKAPK2GAAMAPT | |
| SCHEMBL768982 | 0.74 | ALDH1A1 (0.54) | ALDH1A1F12 | |
| SCHEMBL30899479 | 0.74 | ALDH1A1 (0.54) | ALDH1A1F12 | |
| SCHEMBL29597389 | 0.74 | TSHR (0.97) | TSHRNPSR1MAPKAPK2GAAMAPT |
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-1326849-A1 | BENZODIAZEPINE DERIVATIVES AS INHIBITORS OF GAMMA SECRETASE | Merck Sharp & Dohme Limited (GB) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002030912-A1 | BENZODIAZEPINE DERIVATIVES AS INHIBITORS OF GAMMA SECRETASE | MERCK SHARP & DOHME LIMITED (GB) | 2002-04-18 | — | — | WO | disclosed |