Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | LPAR3 | Q9UBY5 | 8/20 | 0.46 |
| ▸ | LPAR2 | Q9HBW0 | 6/20 | 0.46 |
| ▸ | LPAR1 | Q92633 | 4/20 | 0.46 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | TPI1 | P60174 | 2/20 | 0.37 |
| ▸ | PGK1 | P00558 | 1/20 | 0.36 |
| ▸ | PGK2 | P07205 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | CSNK2A3 | Q8NEV1 | 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 | |
|---|---|---|---|---|
| SCHEMBL991756 | 1.00 | — | — | |
| SCHEMBL27658317 | 0.97 | — | — | |
| SCHEMBL18632655 | 0.97 | — | — | |
| Phosphoric Acid SCHEMBL27536489 | 0.97 | ALDH1A1 (0.57) | ALDH1A1LPAR3LPAR2LPAR1MPI | |
| Hydrochloric Acid SCHEMBL11424377 | 0.97 | ALDH1A1 (0.57) | ALDH1A1LPAR3LPAR2LPAR1MPI | |
| SCHEMBL27590175 | 0.97 | — | — | |
| Hydrazine SCHEMBL28767472 | 0.95 | ALDH1A1 (0.55) | ALDH1A1LPAR3LPAR2LPAR1MPI | |
| SCHEMBL9064985 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LPAR3LPAR2LPAR1MPI | |
| SCHEMBL1477859 | 0.83 | — | — | |
| SCHEMBL11143917 | 0.83 | ALDH1A1 (0.55) | ALDH1A1LPAR3LPAR2LPAR1MPI |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116223679-A | Method for simultaneously detecting 1, 2-dichloroethane and 2-chloroethyl phosphate mono-2-chloroethyl ester | 中国检验检疫科学研究院粤港澳大湾区研究院 | 2023-06-06 | — | — | CN | disclosed |
| CN-111812242-B | Method for simultaneously detecting multiple toxic and harmful substances in consumer product | 青岛海关技术中心 | 2022-07-05 | — | — | CN | disclosed |