Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2498271 | 1.00 | NQO1 (0.59) | NQO1KDM4ETSHRTDP1MAPT | |
| SCHEMBL9488121 | 0.91 | NQO1 (0.54) | NQO1KDM4ETSHRTDP1MAPT | |
| SCHEMBL19612211 | 0.89 | KDM4E (0.61) | NQO1KDM4ETSHRMAPTKMT2A | |
| SCHEMBL6343598 | 0.83 | NQO1 (0.44) | NQO1KDM4ETSHRTDP1MAPT | |
| SCHEMBL17127349 | 0.83 | NQO1 (0.56) | NQO1KDM4ETSHRTDP1MAPT | |
| SCHEMBL11208564 | 0.82 | LTA4H (0.63) | NQO1KDM4ETDP1MAPTMEN1 | |
| SCHEMBL1787479 | 0.82 | KDM4E (0.50) | NQO1KDM4ETSHRMAPTPOLB | |
| SCHEMBL1787478 | 0.82 | KDM4E (0.50) | NQO1KDM4ETSHRMAPTMEN1 | |
| SCHEMBL9715643 | 0.82 | CA2 (0.64) | NQO1KDM4ETSHRMAPTMEN1 | |
| SCHEMBL8558909 | 0.82 | NQO1 (0.54) | NQO1KDM4ETSHRTDP1MAPT |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117897439-A | Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition | 株式会社LG化学 | 2024-04-16 | — | — | CN | claimed |
| CN-117897440-A | Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition | 株式会社LG化学 | 2024-04-16 | — | — | CN | claimed |
| CN-108069847-B | Method for synthesizing trapbutine | 湖南尔康制药股份有限公司 | 2022-06-17 | — | — | CN | claimed |
| CN-114621375-B | Rubber with backbone and end-group functionalization | 固特异轮胎和橡胶公司 | 2024-06-18 | — | — | CN | disclosed |
| CN-117897439-A | Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition | 株式会社LG化学 | 2024-04-16 | — | — | CN | disclosed |
| CN-117897440-A | Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition | 株式会社LG化学 | 2024-04-16 | — | — | CN | disclosed |
| CN-108069847-B | Method for synthesizing trapbutine | 湖南尔康制药股份有限公司 | 2022-06-17 | — | — | CN | disclosed |
| CN-108069847-B | Method for synthesizing trapbutine | 湖南尔康制药股份有限公司 | 2022-06-17 | — | — | CN | disclosed |
| CN-114621375-A | Rubber with main chain and end group functionalization | 固特异轮胎和橡胶公司 | 2022-06-14 | — | — | CN | disclosed |