Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NTMT1 | Q9BV86 | 14/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL15578271 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NSD2LMNANTMT1RAF1 | |
| SCHEMBL29387286 | 0.88 | ALDH1A1 (0.41) | ALDH1A1NSD2LMNANTMT1RAF1 | |
| SCHEMBL16933663 | 0.88 | ALDH1A1 (0.41) | ALDH1A1NSD2LMNANTMT1RAF1 | |
| SCHEMBL29387446 | 0.85 | L3MBTL1 (0.48) | ALDH1A1NSD2LMNANTMT1 | |
| SCHEMBL16933575 | 0.85 | L3MBTL1 (0.48) | ALDH1A1NSD2LMNANTMT1 | |
| SCHEMBL16933692 | 0.84 | MMP13 (0.46) | NTMT1 | |
| SCHEMBL29386743 | 0.80 | NTMT1 (0.48) | NTMT1 | |
| SCHEMBL15577911 | 0.79 | L3MBTL1 (0.47) | ALDH1A1NTMT1 | |
| SCHEMBL15578267 | 0.78 | NTMT1 (0.52) | NTMT1 | |
| SCHEMBL12614806 | 0.77 | NTMT1 (0.57) | ALDH1A1NTMT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114533729-A | Glucosylceramide synthase inhibitors | 建新公司 | 2022-05-27 | — | — | CN | disclosed |
| CN-108864076-B | Glucosylceramide synthase inhibitors | 建新公司 | 2022-02-11 | — | — | CN | disclosed |