Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | RORC | P51449 | 3/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28700602 | 0.89 | NLRP3 (0.53) | NLRP3RORCSMN1; SMN2EPHX2MAPT | |
| SCHEMBL28698365 | 0.87 | ALDH1A1 (0.52) | NLRP3ALDH1A1BCHEACHESMN1; SMN2 | |
| SCHEMBL28684550 | 0.85 | MEN1 (0.61) | ALDH1A1RORCSMN1; SMN2EPHX2MAPT | |
| SCHEMBL28933313 | 0.84 | MEN1 (0.54) | NLRP3ALDH1A1SMN1; SMN2EPHX2MAPT | |
| SCHEMBL28933319 | 0.84 | EPHX2 (0.47) | NR1H4ALDH1A1RORCBCHEACHE | |
| SCHEMBL28684557 | 0.84 | ALDH1A1 (0.57) | NLRP3ALDH1A1SMN1; SMN2EPHX2MAPT | |
| SCHEMBL28704857 | 0.84 | GAA (0.58) | ALDH1A1SMN1; SMN2EPHX2MAPTHPGD | |
| SCHEMBL28691395 | 0.84 | ALDH1A1 (0.64) | NLRP3ALDH1A1SMN1; SMN2MAPTHPGD | |
| SCHEMBL28708144 | 0.82 | RAB9A (0.66) | NLRP3ALDH1A1SMN1; SMN2MAPTHPGD | |
| SCHEMBL28685814 | 0.81 | KMT2A (0.56) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A |
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-114057630-B | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2023-06-02 | — | — | CN | claimed |
| CN-114057630-A | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2022-02-18 | — | — | CN | claimed |
| CN-114057630-B | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2023-06-02 | — | — | CN | disclosed |
| CN-114057630-A | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2022-02-18 | — | — | CN | disclosed |