Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL58507 | 0.91 | — | — | |
| SCHEMBL28195226 | 0.89 | — | — | |
| SCHEMBL27593502 | 0.87 | TP53 (0.44) | TP53IDO1CYP2A6 | |
| SCHEMBL27765919 | 0.83 | TP53 (0.41) | TP53CYP2A6 | |
| SCHEMBL28140800 | 0.79 | TP53 (0.37) | TP53 | |
| SCHEMBL27430888 | 0.78 | TP53 (0.44) | TP53CYP2A6 | |
| SCHEMBL2256246 | 0.75 | BCL2 (0.47) | TP53IDO1CYP2A6 | |
| SCHEMBL128292 | 0.74 | — | — | |
| SCHEMBL1370559 | 0.73 | TP53 (0.39) | TP53CYP2A6 | |
| SCHEMBL230025 | 0.73 | — | — |
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-104540871-B | The preparation method of aromatic compound | 住友化学株式会社 | 2016-08-24 | — | — | CN | disclosed |