Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | BLVRB | P30043 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25299060 | 1.00 | NPC1 (0.58) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL27988592 | 0.87 | NPC1 (0.56) | NPC1RAB9AL3MBTL1SMPD1SMN1; SMN2 | |
| SCHEMBL59281 | 0.87 | ALDH1A1 (0.56) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL60213 | 0.86 | L3MBTL1 (0.55) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL29800132 | 0.86 | NPC1 (0.61) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL28953168 | 0.86 | NPC1 (0.61) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL22442371 | 0.85 | NPC1 (0.54) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL29784348 | 0.85 | NPC1 (0.54) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL60707 | 0.83 | RAB9A (0.67) | NPC1RAB9AL3MBTL1MAOABLVRB | |
| SCHEMBL3100143 | 0.82 | ACACB (0.55) | SMPD1NOTUMALDH1A1TSHR |
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-119421877-A | Substituted heterocyclic compounds as HSET inhibitors | 默克专利股份公司 | 2025-02-11 | — | — | CN | disclosed |