Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.33 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL27732544 | 0.78 | FKBP5 (0.31) | FKBP5 | |
| SCHEMBL485899 | 0.63 | — | — | |
| Fluoride SCHEMBL28006656 | 0.61 | — | — | |
| Fluoride SCHEMBL27944277 | 0.59 | MAOA (0.45) | DAOHDAC8HDAC6AURKAAURKB | |
| SCHEMBL30659527 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL7988951 | 0.58 | HDAC6 (0.40) | DAOHDAC8HDAC6AURKAAURKB | |
| Fluoride SCHEMBL29179319 | 0.57 | MAOA (0.44) | DAOHDAC8HDAC6AURKAAURKB | |
| Fluoride SCHEMBL28214761 | 0.57 | MAOA (0.44) | DAOHDAC8HDAC6AURKAAURKB | |
| SCHEMBL31512727 | 0.57 | — | — | |
| SCHEMBL145329 | 0.56 | — | — |
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-108865113-B | For detecting Fe3+、Co2+Naphthaldehyde-dipyrrole boron fluorine fluorescent molecular probe and preparation method thereof | 德州学院 | 2020-10-30 | — | — | CN | disclosed |