Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 2/20 | 0.34 |
| ▸ | IDH2 | P48735 | 2/20 | 0.34 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29989648 | 1.00 | IDH1 (0.34) | IDH1IDH2MALT1 | |
| SCHEMBL29162014 | 1.00 | IDH1 (0.34) | IDH1IDH2MALT1 | |
| SCHEMBL28974175 | 0.77 | MEN1 (0.37) | — | |
| SCHEMBL26194412 | 0.77 | MEN1 (0.37) | — | |
| SCHEMBL28974173 | 0.77 | MEN1 (0.37) | — | |
| SCHEMBL23985441 | 0.77 | MEN1 (0.37) | — | |
| SCHEMBL14737553 | 0.77 | NOS3 (0.39) | — | |
| SCHEMBL30173672 | 0.77 | MEN1 (0.37) | — | |
| SCHEMBL30342106 | 0.74 | — | — | |
| SCHEMBL30798747 | 0.74 | — | — |
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-117597339-A | Aryl 3-oxo-piperazine carboxamides and heteroaryl 3-oxo-piperazine carboxamides as NAV1.8 inhibitors | 默沙东有限责任公司 | 2024-02-23 | — | — | CN | disclosed |