Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30632963 | 0.80 | NFE2L2 (0.55) | GRM4NFE2L2 | |
| SCHEMBL30632897 | 0.77 | NFE2L2 (0.50) | NFE2L2 | |
| SCHEMBL30633073 | 0.75 | NPC1 (0.36) | CYP2C19NFE2L2 | |
| SCHEMBL30632943 | 0.75 | NFE2L2 (0.33) | CYP2C19GRM4NFE2L2 | |
| SCHEMBL15870902 | 0.74 | — | — | |
| SCHEMBL28473621 | 0.73 | CYP1A1 (0.37) | NFE2L2 | |
| SCHEMBL30632983 | 0.72 | NAPRT (0.36) | GRM4NFE2L2 | |
| SCHEMBL30632891 | 0.72 | NPC1 (0.41) | CYP2C19 | |
| SCHEMBL30632951 | 0.71 | NFE2L2 (0.44) | NFE2L2 | |
| SCHEMBL30632972 | 0.70 | CYP11B2 (0.56) | GRM4 |
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-111886234-B | Heterocyclic mitochondrial activity inhibitors and uses thereof | 蒙特利尔大学 | 2023-12-15 | — | — | CN | disclosed |