Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL999439 | 0.97 | ALDH1A1 (0.48) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| SCHEMBL28285490 | 0.95 | ALDH1A1 (0.46) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| Ethylene Glycol SCHEMBL27952391 | 0.89 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRB | |
| N,N-Dimethylethanaminium SCHEMBL23833781 | 0.83 | ALDH1A1 (0.37) | ALDH1A1TSHRTHRB | |
| SCHEMBL27610743 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| SCHEMBL28862258 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| SCHEMBL493542 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| SCHEMBL3044142 | 0.76 | CA2 (0.35) | TSHRTDP1CA2 | |
| SCHEMBL28094491 | 0.75 | ALDH1A1 (0.46) | ALDH1A1TSHRTHRBTDP1HSD17B10 | |
| SCHEMBL27484447 | 0.75 | ALDH1A1 (0.46) | ALDH1A1TSHRTHRBTDP1HSD17B10 |
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-114085446-A | Creep-resistant composite material and preparation method thereof | 四川大学 | 2022-02-25 | — | — | CN | disclosed |