Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 9/20 | 0.43 |
| ▸ | CTSL | P07711 | 4/20 | 0.43 |
| ▸ | CTSB | P07858 | 4/20 | 0.43 |
| ▸ | CTSH | P09668 | 2/20 | 0.43 |
| ▸ | ACE | P12821 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28628480 | 0.83 | SCN9A (0.54) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL27438213 | 0.83 | SCN9A (0.54) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL27502333 | 0.81 | SCN9A (0.57) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL28336154 | 0.80 | SCN9A (0.56) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL28356129 | 0.77 | SCN9A (0.43) | SCN9ACTSKCTSLCTSBCTSH | |
| SCHEMBL28529040 | 0.75 | SCN9A (0.53) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL28029609 | 0.75 | SCN9A (0.56) | SCN9ACTSKCTSLCTSBACE | |
| SCHEMBL15311168 | 0.73 | CTSK (0.49) | SCN9ACTSKCTSLCTSBNPC1 | |
| SCHEMBL28359858 | 0.73 | SCN9A (0.48) | SCN9ACTSKCTSLCTSBNPC1 | |
| SCHEMBL14716956 | 0.73 | CTSK (0.49) | SCN9ACTSKCTSLCTSBNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100537523-C | Phenylamide and pyridylamide beta-secretase inhibitors for the treatment of alzheimer's disease | MERCK & CO INC (US) | 2009-09-09 | — | — | CN | disclosed |
| CN-1898199-A | Phenylamide and pyridylamide beta-secretase inhibitors for the treatment of alzheimer's disease | MERCK & CO INC (US) | 2007-01-17 | — | — | CN | disclosed |