Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6751312 | 0.87 | GLS (0.62) | GLSKDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5691486 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL11438406 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL11454059 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL6115144 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL11440000 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL6115308 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL6114878 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL6115309 | 0.83 | GLS (0.58) | GLSKDM4EALDH1A1GLALMNA | |
| SCHEMBL13452988 | 0.82 | GLS (0.53) | GLSKDM4ECYP1A2CYP3A4CYP2D6 |
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-113582928-A | Amino-phenol-oxygen-group zinc complex containing (substituted) pyrazole ring and preparation method and application thereof | 华东理工大学 | 2021-11-02 | — | — | CN | disclosed |