Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 6/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28118921 | 1.00 | ALDH1A1 (0.43) | ALDH1A1HSD17B10L3MBTL1TDP1ALOX12 | |
| SCHEMBL902585 | 0.84 | KIF11 (0.57) | KIF11CYP3A4CYP2C9CYP2C19KCNH2 | |
| SCHEMBL29674396 | 0.84 | KIF11 (0.57) | KIF11CYP3A4CYP2C9CYP2C19KCNH2 | |
| SCHEMBL28472455 | 0.82 | KIF11 (0.59) | KIF11CYP3A4CYP2C9CYP2C19KCNH2 | |
| SCHEMBL28118918 | 0.81 | HTT (0.46) | ALDH1A1KIF11MAPTHTTCYP1A2 | |
| SCHEMBL3630705 | 0.76 | KIF11 (0.68) | KIF11CYP3A4CYP2C9CYP2C19KCNH2 | |
| SCHEMBL28118490 | 0.75 | TDP1 (0.37) | ALDH1A1HSD17B10L3MBTL1TDP1ALOX12 | |
| Octadecylamine SCHEMBL5861110 | 0.73 | DNM1 (0.52) | ALDH1A1HSD17B10L3MBTL1TDP1ALOX12 | |
| Diphenylamine SCHEMBL3650060 | 0.73 | DNM1 (0.52) | ALDH1A1HSD17B10L3MBTL1TDP1ALOX12 | |
| SCHEMBL459552 | 0.72 | KIF11 (0.41) | TSHRKIF11CYP3A4CYP2C9CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106414587-B | Rubber composition, tire, amine compounds and age resister | 大塚化学株式会社 | 2019-02-12 | — | — | CN | disclosed |
| CN-106414587-A | Rubber composition, tire, amine compound and anti-aging agent | 大塚化学株式会社 | 2017-02-15 | — | — | CN | disclosed |