Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 8/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | CCR6 | P51684 | 3/20 | 0.31 |
| ▸ | USP7 | Q93009 | 1/20 | 0.31 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | STK17B | O94768 | 1/20 | 0.30 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18567273 | 0.86 | BACE1 (0.46) | BACE1PTGESPTGS1BACE2NPY5R | |
| SCHEMBL13466601 | 0.80 | BACE1 (0.63) | BACE1BACE2 | |
| SCHEMBL18567381 | 0.79 | BACE1 (0.41) | BACE1BACE2 | |
| SCHEMBL18567374 | 0.77 | BACE1 (0.49) | BACE1BACE2 | |
| SCHEMBL18567406 | 0.77 | BACE1 (0.49) | BACE1BACE2 | |
| SCHEMBL18567947 | 0.77 | BACE1 (0.48) | BACE1BACE2 | |
| SCHEMBL18567732 | 0.75 | BACE1 (0.45) | BACE1BACE2 | |
| SCHEMBL10329044 | 0.75 | BACE1 (0.56) | BACE1BACE2 | |
| SCHEMBL18567394 | 0.73 | BACE1 (0.46) | BACE1BACE2 | |
| SCHEMBL18567802 | 0.72 | BACE1 (0.51) | BACE1BACE2HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2697210-B1 | 5-SUBSTITUTED IMINOTHIAZINES AND THEIR MONO-AND DIOXIDES AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME (US) | 2017-03-01 | — | — | EP | disclosed |