Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | GCK | P35557 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | MOGAT2 | Q3SYC2 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | FKBP1A | P62942 | 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 | |
|---|---|---|---|---|
| SCHEMBL31150293 | 1.00 | PDE2A (0.39) | PDE2AGCKNPC1KMT2AGAA | |
| SCHEMBL25793697 | 0.88 | CYP2D6 (0.39) | NPC1KMT2AGAARAB9APRKDC | |
| SCHEMBL31150291 | 0.88 | CYP2D6 (0.39) | NPC1KMT2AGAARAB9APRKDC | |
| SCHEMBL25793692 | 0.79 | HRH3 (0.37) | PDE2AHRH3 | |
| SCHEMBL31150269 | 0.79 | HRH3 (0.37) | PDE2AHRH3 | |
| SCHEMBL17669409 | 0.78 | MAOA (0.35) | NPC1MAOAHRH3 | |
| SCHEMBL16688831 | 0.78 | HPGD (0.39) | PDE2ANPC1RAB9ACHRM2CHRM1 | |
| SCHEMBL18702788 | 0.77 | NFE2L2 (0.46) | PDE2AGCKNPC1KMT2AGAA | |
| SCHEMBL31150281 | 0.77 | CYP1A2 (0.34) | NPC1KMT2ARAB9AMAOAMEN1 | |
| SCHEMBL31150297 | 0.77 | PDIA6 (0.35) | NPC1KMT2AGAARAB9AMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023131116-A1 | CARBONYL BRIDGED HETEROCYCLIC COMPOUND, AND COMPOSITION AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2023-07-13 | — | — | WO | disclosed |