Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | GLA | P06280 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29467363 | 0.87 | ALDH1A1 (0.58) | ALDH1A1KDM4EGAAGLALMNA | |
| SCHEMBL2847922 | 0.87 | ALDH1A1 (0.58) | ALDH1A1KDM4EGAAGLALMNA | |
| SCHEMBL9173088 | 0.83 | KDM4E (0.54) | ALDH1A1KDM4EGAAGLALMNA | |
| SCHEMBL17260712 | 0.81 | MAPT (0.44) | ALDH1A1KDM4EGAACYP1A2CYP2C9 | |
| SCHEMBL4619119 | 0.79 | KDM4C (0.48) | ALDH1A1KDM4EL3MBTL1HTTKMT2A | |
| SCHEMBL29955774 | 0.79 | KDM4C (0.48) | ALDH1A1KDM4EL3MBTL1HTTKMT2A | |
| SCHEMBL68952 | 0.78 | KDM4E (0.70) | ALDH1A1KDM4EGAAGLALMNA | |
| SCHEMBL29416299 | 0.78 | KDM4E (0.70) | ALDH1A1KDM4EGAAGLALMNA | |
| SCHEMBL30874483 | 0.77 | SIRT3 (0.55) | ALDH1A1KDM4EL3MBTL1CASP1HTT | |
| SCHEMBL20399076 | 0.76 | KDM4E (0.50) | ALDH1A1KDM4EGAAGLALMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118302417-A | NLRP3 inhibitors | PTC医疗公司 | 2024-07-05 | — | — | CN | disclosed |
| EP-4392414-A1 | INHIBITORS OF NLRP3 | PTC Therapeutics, Inc. (US) | 2024-07-03 | — | — | EP | disclosed |
| WO-2023028534-A1 | INHIBITORS OF NLRP3 | PTC THERAPEUTICS, INC. (US) | 2023-03-02 | — | — | WO | disclosed |
| WO-2023028534-A1 | INHIBITORS OF NLRP3 | PTC THERAPEUTICS, INC. (US) | 2023-03-02 | — | — | WO | disclosed |