Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.45 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.45 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL28706311 | 0.88 | ALDH1A1 (0.48) | TDP1KMT2AMEN1NPC1CYP1A2 | |
| SCHEMBL28708127 | 0.88 | CA12 (0.53) | KMT2AMEN1CYP1A2KDM4EALDH1A1 | |
| SCHEMBL28697076 | 0.85 | ELOVL1 (0.52) | KMT2AMEN1NPC1CYP1A2ALDH1A1 | |
| SCHEMBL28684562 | 0.85 | KCNJ5 (0.56) | NPC1KDM4EALDH1A1MAPK8LMNA | |
| SCHEMBL28704823 | 0.84 | MEN1 (0.57) | KMT2AMEN1KDM4EALDH1A1HPGD | |
| SCHEMBL28706294 | 0.83 | KMT2A (0.58) | KMT2AMEN1KDM4EALDH1A1HPGD | |
| SCHEMBL28697085 | 0.83 | KDM4E (0.47) | KMT2AMEN1NPC1CYP1A2KDM4E | |
| SCHEMBL28698365 | 0.82 | ALDH1A1 (0.52) | KMT2AMEN1CYP1A2KDM4EALDH1A1 | |
| SCHEMBL28690641 | 0.82 | NR2E1 (0.51) | KMT2AMEN1CYP1A2ANO1CYP2D6 | |
| SCHEMBL28933313 | 0.80 | MEN1 (0.54) | KMT2AMEN1CYP1A2KDM4EALDH1A1 |
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 |