Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL24424784 | 1.00 | BACE1 (0.34) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL24424783 | 1.00 | BACE1 (0.34) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL25090994 | 0.93 | KDM5A (0.32) | KDM5A | |
| SCHEMBL29243488 | 0.92 | MAPK1 (0.39) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL29585608 | 0.92 | MAPK1 (0.39) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL25090915 | 0.92 | MAPK1 (0.39) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL25090914 | 0.92 | MAPK1 (0.39) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL29583203 | 0.91 | BACE1 (0.35) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL24424616 | 0.91 | BACE1 (0.35) | BACE1CYP2D6PKMCYP2C19MAPK1 | |
| SCHEMBL24424120 | 0.90 | KDM5A (0.34) | BACE1CYP2D6PKMCYP2C19MAPK1 |
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-116635380-A | PPARgamma modulators and methods of use | 卫材R&D管理有限公司 | 2023-08-22 | — | — | CN | disclosed |