Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9465136 | 0.94 | PTGS2 (0.52) | PTGS2CYP1A2MAPTCYP4F2CYP4A11 | |
| SCHEMBL9465134 | 0.94 | PTGS2 (0.52) | PTGS2CYP1A2MAPTCYP4F2CYP4A11 | |
| SCHEMBL10904338 | 0.85 | PTGS2 (0.47) | PTGS2CYP1A2MAPTTSHRTP53 | |
| SCHEMBL9427239 | 0.85 | GSK3B (0.55) | CYP1A2MAPTCYP3A4CYP2C19NPC1 | |
| SCHEMBL9427247 | 0.85 | GSK3B (0.55) | CYP1A2MAPTCYP3A4CYP2C19NPC1 | |
| SCHEMBL9208139 | 0.85 | GSK3B (0.55) | CYP1A2MAPTCYP3A4CYP2C19NPC1 | |
| SCHEMBL10653530 | 0.84 | AKT1 (0.51) | CYP4F2CYP4A11TSHRLMNAMAOB | |
| SCHEMBL29016750 | 0.84 | AKT1 (0.51) | CYP4F2CYP4A11TSHRLMNAMAOB | |
| SCHEMBL10384261 | 0.81 | ALDH1A1 (0.57) | PTGS2MAPTCYP4F2CYP4A11TSHR | |
| SCHEMBL10505231 | 0.81 | TBXAS1 (0.50) | CYP1A2MAPTTP53CYP3A4MEN1 |
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-118206514-A | Reaction method for preparing olefin by deacylation of visible light induced ketone | 国科大杭州高等研究院 | 2024-06-18 | — | — | CN | disclosed |