Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 2/20 | 0.31 |
| ▸ | TLR9 | Q9NR96 | 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 | |
|---|---|---|---|---|
| SCHEMBL8864683 | 0.77 | CA2 (0.48) | CYP1A1CYP1A2CYP1B1AR | |
| SCHEMBL30833875 | 0.76 | MAPT (0.42) | CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL30792548 | 0.73 | CA12 (0.56) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL26118583 | 0.73 | ACHE (0.56) | CYP1A2 | |
| SCHEMBL1416677 | 0.73 | CA12 (0.56) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL8866413 | 0.73 | AR (0.44) | CYP1A1CYP1A2CYP1B1APPAR | |
| SCHEMBL8078442 | 0.72 | ALDH1A1 (0.47) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL5637248 | 0.72 | NFE2L2 (0.38) | — | |
| SCHEMBL15140350 | 0.72 | TRPV4 (0.46) | — | |
| SCHEMBL8863260 | 0.72 | LMNA (0.40) | CYP1A1CYP1A2CYP1B1 |
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-117986258-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2024-05-07 | — | — | CN | disclosed |