Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL671835 | 1.00 | PKM (0.44) | PKMPTGS2NLRP3CYP4F2CYP4A11 | |
| SCHEMBL34471549 | 0.85 | CYP4F2 (0.57) | NLRP3CYP4F2CYP4A11KMT2AALDH1A1 | |
| SCHEMBL31284578 | 0.84 | KDM4E (0.43) | CYP4F2CYP4A11L3MBTL1KMT2ATDP1 | |
| SCHEMBL27984139 | 0.84 | KDM4E (0.43) | CYP4F2CYP4A11L3MBTL1KMT2ATDP1 | |
| SCHEMBL5009319 | 0.84 | NLRP3 (0.50) | PKMPTGS2NLRP3CYP4F2CYP4A11 | |
| SCHEMBL2420372 | 0.84 | PKM (0.47) | PKMNLRP3CYP4F2CYP4A11L3MBTL1 | |
| SCHEMBL29511550 | 0.83 | PKM (0.53) | PKMNLRP3CYP4F2CYP4A11L3MBTL1 | |
| SCHEMBL852520 | 0.83 | PKM (0.53) | PKMNLRP3CYP4F2CYP4A11L3MBTL1 | |
| SCHEMBL23218990 | 0.83 | PKM (0.46) | PKMNLRP3CYP4F2CYP4A11KMT2A | |
| SCHEMBL30950183 | 0.83 | PKM (0.46) | PKMNLRP3CYP4F2CYP4A11KMT2A |
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-118496142-A | Aryl alkylamine compound and preparation method and application thereof | 仁合益康集团有限公司 | 2024-08-16 | — | — | CN | disclosed |