Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.64 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.64 |
| ▸ | LPAR1 | Q92633 | 6/20 | 0.62 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.62 |
| ▸ | LPAR4 | Q99677 | 2/20 | 0.62 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.62 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.62 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.62 |
| ▸ | CES2 | O00748 | 1/20 | 0.62 |
| ▸ | LPAR6 | P43657 | 1/20 | 0.62 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | P2RY10 | O00398 | 3/20 | 0.55 |
| ▸ | GPR174 | Q9BXC1 | 3/20 | 0.55 |
| ▸ | GPR34 | Q9UPC5 | 3/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL26642826 | 1.00 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL26642821 | 1.00 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL31596828 | 1.00 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL19821339 | 0.97 | SMN1; SMN2 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL17626959 | 0.97 | SMN1; SMN2 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL31577378 | 0.97 | SMN1; SMN2 (0.68) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL38651811 | 0.95 | LPAR1 (0.66) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL25700292 | 0.94 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL31463311 | 0.94 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 | |
| SCHEMBL19864320 | 0.93 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2NR5A2NR5A1LPAR1 |
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-112599240-B | Application of metabolite in cerebral infarction | 河北医科大学第二医院 | 2022-05-20 | — | — | CN | disclosed |