Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29157893 | 1.00 | KDM4E (0.46) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL5166485 | 0.78 | KDM4E (0.56) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL3972355 | 0.75 | ALDH1A1 (0.66) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL27990226 | 0.72 | CA12 (0.48) | KDM4EALDH1A1CYP1A2HPGDCYP17A1 | |
| SCHEMBL143243 | 0.72 | ALDH1A1 (0.67) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL10059378 | 0.70 | ALDH1A1 (0.59) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL27250688 | 0.68 | KDM4E (0.56) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL7830914 | 0.68 | EGLN2 (0.39) | KDM4ECYP1A2HPGDCYP17A1EGLN2 | |
| SCHEMBL356681 | 0.68 | ALDH1A1 (0.80) | KDM4EALDH1A1CYP1A2HPGDBLM | |
| SCHEMBL3968543 | 0.67 | ALDH1A1 (0.46) | KDM4EALDH1A1CYP1A2HPGDBLM |
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-117586227-A | Pirfenidone derivative and preparation method and application thereof | 广东中科药物研究有限公司 | 2024-02-23 | — | — | CN | disclosed |