Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 10/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | BUB1 | O43683 | 1/20 | 0.33 |
| ▸ | MGAT2 | Q10469 | 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 | |
|---|---|---|---|---|
| SCHEMBL7543537 | 0.90 | BACE1 (0.48) | BACE1CTSDMAPKAPK2 | |
| SCHEMBL4549225 | 0.88 | BACE1 (0.36) | BACE1MAPKAPK2 | |
| SCHEMBL7600700 | 0.87 | SCN9A (0.42) | BACE1CTSD | |
| SCHEMBL8437193 | 0.85 | CYP2A6 (0.36) | BACE1 | |
| SCHEMBL13407696 | 0.84 | MAPKAPK2 (0.39) | BACE1MEN1KMT2AMAPKAPK2 | |
| SCHEMBL7539812 | 0.84 | MAPKAPK2 (0.39) | BACE1MEN1KMT2AMAPKAPK2 | |
| SCHEMBL8433127 | 0.84 | MAPKAPK2 (0.39) | BACE1KDM4EHSD17B10FYNMAPKAPK2 | |
| SCHEMBL7544553 | 0.84 | BACE1 (0.40) | BACE1CTSDMAPTGAAKDM4E | |
| SCHEMBL7538440 | 0.82 | BACE1 (0.49) | BACE1CTSD | |
| SCHEMBL4549230 | 0.82 | BACE1 (0.39) | BACE1CTSDBUB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8168641-B2 | Aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-01 | — | — | US | disclosed |