Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 12/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 6/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6693491 | 0.89 | NPC1 (0.42) | NPC1RAB9A | |
| SCHEMBL6685923 | 0.88 | RAB9A (0.38) | EPHX1NPC1RAB9A | |
| SCHEMBL6685915 | 0.84 | RAB9A (0.35) | PARP10NPC1RAB9A | |
| SCHEMBL6691067 | 0.83 | ALDH1A1 (0.35) | PARP10RAB9A | |
| SCHEMBL6690873 | 0.82 | RAB9A (0.40) | SLC6A9SLC6A5NPC1RAB9A | |
| SCHEMBL6687208 | 0.82 | TRPA1 (0.35) | EPHX1ALOX5PARP10 | |
| SCHEMBL6688042 | 0.81 | HTR7 (0.39) | PARP10NPC1 | |
| SCHEMBL6685681 | 0.81 | EPHX2 (0.48) | EPHX1NPC1RAB9A | |
| SCHEMBL6686689 | 0.81 | ALDH1A1 (0.36) | SLC6A9EPHX1PARP10NPC1RAB9A | |
| SCHEMBL6687814 | 0.80 | EPHX1 (0.40) | EPHX1PARP10NPC1RAB9A |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |