Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29176239 | 0.81 | — | — | |
| SCHEMBL7220266 | 0.69 | ALDH1A1 (0.31) | ALDH1A1LMNATP53TSHR | |
| SCHEMBL28992346 | 0.68 | ALDH1A1 (0.30) | ALDH1A1LMNATP53TSHR | |
| SCHEMBL28447016 | 0.66 | TLR4 (0.33) | ALDH1A1LMNATP53TSHR | |
| SCHEMBL8309556 | 0.64 | — | — | |
| SCHEMBL28635879 | 0.62 | — | — | |
| SCHEMBL28840778 | 0.61 | ALDH1A1 (0.30) | ALDH1A1LMNATP53TSHR | |
| SCHEMBL31567960 | 0.61 | ALDH1A1 (0.30) | ALDH1A1LMNATP53TSHR | |
| SCHEMBL28617732 | 0.60 | — | — | |
| SCHEMBL15717508 | 0.60 | — | — |
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-116947713-A | Ring-merging compound and application thereof | 中国科学院上海药物研究所 | 2023-10-27 | — | — | CN | disclosed |