Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.40 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.38 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 2/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TKT | P29401 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 3/20 | 0.36 |
| ▸ | CSF1R | P07333 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2860576 | 0.85 | DAO (0.41) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL2860573 | 0.85 | DAO (0.41) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL22886675 | 0.80 | CYP11B1 (0.35) | — | |
| SCHEMBL26479293 | 0.80 | KDM4E (0.47) | KDM1AMAOAMAOBNAMPTCYP2C9 | |
| SCHEMBL31639522 | 0.80 | CYP11B1 (0.35) | — | |
| SCHEMBL14614919 | 0.79 | KDM1A (0.49) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL297140 | 0.77 | KDM1A (0.50) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL13061262 | 0.74 | KDM1A (0.48) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL30887521 | 0.74 | KDM1A (0.45) | KDM1AMAOAMAOBTRPV4KCNQ3 | |
| SCHEMBL29196346 | 0.74 | KDM1A (0.45) | KDM1AMAOAMAOBTRPV4KCNQ3 |
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 |