Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8465943 | 1.00 | TP53 (0.33) | TP53TSHR | |
| SCHEMBL12166805 | 0.80 | TP53 (0.34) | TP53TSHR | |
| SCHEMBL12166803 | 0.80 | TRPA1 (0.30) | — | |
| SCHEMBL24483142 | 0.74 | TSHR (0.33) | TP53TSHR | |
| SCHEMBL1270359 | 0.69 | TSHR (0.41) | TP53TSHR | |
| SCHEMBL12166922 | 0.68 | CES2 (0.30) | — | |
| SCHEMBL12166831 | 0.67 | TP53 (0.38) | TP53TSHR | |
| SCHEMBL24483514 | 0.67 | GLB1 (0.33) | — | |
| SCHEMBL23988604 | 0.67 | CA1 (0.42) | TP53TSHR | |
| SCHEMBL23988644 | 0.67 | CA1 (0.42) | TP53TSHR |
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-113788734-B | Synthesis method of (1S, 2S, 4S) -beta-elemene and intermediate thereof | 粤澳中医药科技产业园开发有限公司 | 2022-11-11 | — | — | CN | disclosed |