Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675753 | 0.83 | NPC1 (0.47) | L3MBTL1NPC1RAB9AROCK2KDM4E | |
| SCHEMBL29675931 | 0.80 | MAPK1 (0.41) | L3MBTL1NPC1RAB9AROCK2MAPK1 | |
| SCHEMBL20738649 | 0.80 | KCNB1 (0.45) | NPC1RAB9AROCK2MAPK1ROCK1 | |
| SCHEMBL29676371 | 0.76 | CTSA (0.44) | NPC1RAB9AMAPK1KDM4EALDH1A1 | |
| SCHEMBL29675688 | 0.74 | MAPK1 (0.46) | NPC1RAB9AROCK2MAPK1GSK3B | |
| SCHEMBL29675681 | 0.74 | ROCK2 (0.34) | L3MBTL1NPC1RAB9AROCK2MAPK1 | |
| SCHEMBL29676029 | 0.73 | PIK3CA (0.50) | RAB9AMAPK1KDM4EGSK3B | |
| SCHEMBL29675928 | 0.72 | KCNH2 (0.40) | L3MBTL1NPC1RAB9AMAPK1ALDH1A1 | |
| SCHEMBL18765697 | 0.71 | CYP26A1 (0.47) | ROCK2MAPK1KDM4EALDH1A1RIPK1 | |
| SCHEMBL31037006 | 0.71 | MAPK1 (0.46) | MAPK1ALDH1A1RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |