Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ACACB | O00763 | 8/20 | 0.42 |
| ▸ | ACACA | Q13085 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675755 | 0.83 | L3MBTL1 (0.38) | NPC1RAB9AL3MBTL1ALDH1A1ROCK2 | |
| SCHEMBL21078851 | 0.81 | ROCK2 (0.55) | NPC1RAB9AL3MBTL1ACACBROCK2 | |
| SCHEMBL29676067 | 0.80 | NPC1 (0.44) | NPC1RAB9AL3MBTL1ACACBACACA | |
| SCHEMBL29675578 | 0.79 | NPC1 (0.44) | NPC1RAB9AL3MBTL1ACACBACACA | |
| SCHEMBL29676226 | 0.77 | ACACB (0.45) | NPC1RAB9AL3MBTL1ACACBACACA | |
| SCHEMBL12975641 | 0.77 | ROCK2 (0.51) | L3MBTL1ACACBACACAALDH1A1HTT | |
| SCHEMBL21079020 | 0.76 | CYP2C19 (0.41) | ALDH1A1ROCK2ROCK1AAK1 | |
| SCHEMBL18133483 | 0.75 | JAK2 (0.50) | NPC1RAB9AL3MBTL1ALDH1A1LMNA | |
| SCHEMBL29675922 | 0.74 | NPC1 (0.40) | NPC1RAB9AL3MBTL1ACACBACACA | |
| SCHEMBL29676386 | 0.73 | HRH4 (0.44) | NPC1RAB9AL3MBTL1ACACBKDM4E |
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 |