Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14110406 | 0.89 | ALOX5 (0.50) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL3457762 | 0.86 | ALDH1A1 (0.47) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL3657887 | 0.84 | SIGMAR1 (0.35) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL16179158 | 0.82 | ALDH1A1 (0.57) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL10771689 | 0.81 | KMT2A (0.47) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL29101074 | 0.80 | MEN1 (0.41) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL5170828 | 0.78 | CTSS (0.48) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL5373794 | 0.76 | ALOX5 (0.47) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL6875797 | 0.75 | TAAR1 (0.46) | KMT2AMEN1NPC1RAB9ATDP1 | |
| SCHEMBL23805069 | 0.74 | ALDH1A1 (0.52) | KMT2AMEN1NPC1RAB9ATDP1 |
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-1744755-B1 | COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS | IRM LLC (BM) | 2012-12-05 | — | — | EP | claimed |