Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 9/20 | 0.55 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.48 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.48 |
| ▸ | FDPS | P14324 | 8/20 | 0.45 |
| ▸ | GGPS1 | O95749 | 5/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8094732 | 0.97 | CES1 (0.52) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL12059209 | 0.90 | CES1 (0.48) | CES1CES2LPAR1LPAR3 | |
| SCHEMBL28792699 | 0.86 | CES1 (0.47) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL9408624 | 0.84 | CES1 (0.46) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL13849607 | 0.80 | CES2 (0.48) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL10528525 | 0.80 | CES2 (0.48) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL11603249 | 0.80 | CES2 (0.48) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL28851669 | 0.79 | CES1 (0.41) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL23825184 | 0.79 | CES2 (0.52) | CES1CES2LPAR1LPAR3FDPS | |
| SCHEMBL23825005 | 0.79 | CES2 (0.52) | CES1CES2LPAR1LPAR3FDPS |
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 |
|---|---|---|---|---|---|---|---|
| EP-0577446-A2 | Process for preparing optically active halogen-containing alcohols | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1994-01-05 | — | — | EP | disclosed |