Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 8/20 | 0.60 |
| ▸ | NFKB2 | Q00653 | 8/20 | 0.60 |
| ▸ | RELA | Q04206 | 8/20 | 0.60 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.50 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 3/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25205679 | 0.89 | NFKB1 (0.63) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL30383093 | 0.89 | NFKB1 (0.63) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL25205681 | 0.89 | NFKB1 (0.63) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL25184989 | 0.86 | AURKA (0.61) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL25265167 | 0.86 | AURKA (0.61) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL31232999 | 0.86 | AURKA (0.61) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL1728182 | 0.84 | NFKB1 (0.58) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL1728183 | 0.84 | NFKB1 (0.58) | NFKB1NFKB2RELASLC5A1SLC5A2 | |
| SCHEMBL16098173 | 0.84 | MAOB (0.61) | NFKB1NFKB2RELABACE1MAOB | |
| SCHEMBL16100756 | 0.84 | MAOB (0.61) | NFKB1NFKB2RELABACE1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022113047-A1 | 4'-SUBSTITUTED ANALOGUES OF FISETIN AND THEIR USE IN THE TREATMENT OF CANCER | STELLENBOSCH UNIVERSITY (ZA) | 2022-06-02 | — | — | WO | disclosed |