Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 14/20 | 0.65 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3630705 | 0.84 | KIF11 (0.68) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3985816 | 0.82 | KIF11 (0.65) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL847003 | 0.80 | KIF11 (0.44) | KIF11KCNN4TAAR1 | |
| SCHEMBL1660722 | 0.79 | KCNN4 (0.46) | KIF11KCNN4TAAR1 | |
| SCHEMBL2679441 | 0.79 | KIF11 (1.00) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8217294 | 0.78 | MAOA (0.48) | TAAR1MAOA | |
| SCHEMBL28193226 | 0.78 | SCN5A (0.42) | KIF11KCNN4TAAR1 | |
| Bromide SCHEMBL14976365 | 0.77 | KIF11 (0.95) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| Water SCHEMBL11129297 | 0.77 | KIF11 (0.95) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28472455 | 0.77 | KIF11 (0.59) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 |
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-107216260-B | A kind of compound and its application as epoxy hardener | 雅安市弘利展化工有限公司 | 2019-04-12 | — | — | CN | disclosed |