Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | SCN4A | P35499 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 5/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29016594 | 0.85 | MAOB (0.51) | NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL30370207 | 0.81 | EPHX2 (0.44) | NPC1RAB9AMAPTHTTEPHX2 | |
| SCHEMBL29016615 | 0.81 | EPHX2 (0.44) | NPC1RAB9AMAPTHTTEPHX2 | |
| SCHEMBL30370173 | 0.80 | EPHX2 (0.43) | NPC1RAB9AMAPTHTTEPHX2 | |
| SCHEMBL29016655 | 0.80 | EPHX2 (0.43) | NPC1RAB9AMAPTHTTEPHX2 | |
| SCHEMBL29016552 | 0.76 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL7546658 | 0.75 | MAPT (0.57) | NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL8516569 | 0.74 | MAPT (0.44) | NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL27038330 | 0.74 | RAB9A (0.50) | NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL29016569 | 0.73 | APP (0.67) | NPC1RAB9AMAPTEPHX2SCN4A |
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-108689942-B | Nitrogen-containing bicyclic compound, and preparation method and application thereof | 广东东阳光药业有限公司 | 2023-06-09 | — | — | CN | disclosed |