Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 2/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.30 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.30 |
| ▸ | PGR | P06401 | 2/20 | 0.30 |
| ▸ | AR | P10275 | 2/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | LPL | P06858 | 1/20 | 0.30 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30101076 | 1.00 | TRPV4 (0.41) | TRPV4DRD4TDP2S1PR1NR3C2 | |
| SCHEMBL22323989 | 0.88 | TRPV4 (0.36) | TRPV4TDP2ARESR2PDE4B | |
| SCHEMBL29447080 | 0.88 | TRPV4 (0.36) | TRPV4TDP2ARESR2PDE4B | |
| SCHEMBL25260899 | 0.87 | EGFR (0.30) | LPLLIPG | |
| SCHEMBL30936689 | 0.85 | TRPV4 (0.33) | TRPV4 | |
| SCHEMBL25859550 | 0.83 | — | — | |
| SCHEMBL28691150 | 0.82 | TRPV4 (0.33) | TRPV4 | |
| SCHEMBL25300289 | 0.81 | CHRNB2 (0.33) | — | |
| SCHEMBL4141794 | 0.81 | AR (0.42) | TRPV4ARPDE4B | |
| SCHEMBL28934910 | 0.81 | UCHL1 (0.39) | LPLLIPG |
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-116410140-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2023-07-11 | — | — | CN | disclosed |
| CN-115433163-A | NLRP3 inflammasome inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-06 | — | — | CN | disclosed |