Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | STS | P08842 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL22780766 | 0.88 | KDM4E (0.53) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL30533023 | 0.88 | KDM4E (0.53) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL8866245 | 0.87 | KDM4E (0.54) | KDM4EALDH1A1USP2LMNASTS | |
| SCHEMBL2638947 | 0.87 | KDM4E (0.55) | KDM4EALDH1A1USP2LMNASTS | |
| SCHEMBL9019577 | 0.86 | KDM4E (0.44) | KDM4EALDH1A1USP2LMNASTS | |
| SCHEMBL21715808 | 0.86 | KDM4E (0.44) | KDM4EALDH1A1USP2LMNASTS | |
| SCHEMBL8111393 | 0.85 | KDM4E (0.45) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL23915974 | 0.84 | KIF11 (0.52) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL21136501 | 0.84 | ALDH1A1 (0.56) | KDM4EALDH1A1USP2STSMAPT | |
| SCHEMBL3898071 | 0.81 | ALOX5AP (0.56) | ALDH1A1STSMAPTMEN1KMT2A |
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-2022253326-A1 | NLRP3 INFLAMMASOME INHIBITOR AND APPLICATION THEREOF | 药捷安康(南京)科技股份有限公司 | 2022-12-08 | — | — | WO | disclosed |