Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16396084 | 0.83 | IDO1 (0.41) | IDO1DGAT1NPC1LMNAMAPT | |
| SCHEMBL29210554 | 0.82 | IDO1 (0.37) | IDO1DGAT1NPC1LMNAMAPT | |
| SCHEMBL3081062 | 0.81 | KDM4E (0.39) | IDO1DGAT1LMNAMAPTKDM4E | |
| SCHEMBL4182056 | 0.81 | ADORA3 (0.37) | IDO1DGAT1MAPTKDM4EALDH1A1 | |
| SCHEMBL29210490 | 0.78 | IDO1 (0.35) | IDO1DGAT1NPC1LMNAMAPT | |
| SCHEMBL27094181 | 0.77 | KDM4E (0.38) | DGAT1NPC1LMNAMAPTKDM4E | |
| SCHEMBL25586533 | 0.76 | DGAT1 (0.36) | DGAT1NPC1MAPT | |
| SCHEMBL9958624 | 0.76 | NPC1 (0.33) | DGAT1NPC1MAPT | |
| SCHEMBL16396093 | 0.76 | MAPT (0.36) | IDO1DGAT1NPC1MAPTKDM4E | |
| SCHEMBL6321974 | 0.75 | AGTR1 (0.35) | DGAT1NPC1MAPT |
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-117986264-A | Benzo nitrogen-containing polycyclic derivative regulator and preparation method and application thereof | 江苏豪森药业集团有限公司 | 2024-05-07 | — | — | CN | disclosed |