Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | LPAR3 | Q9UBY5 | 5/20 | 0.43 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.43 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5971975 | 0.93 | LPAR3 (0.52) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL5250599 | 0.91 | LPAR3 (0.55) | CYP3A4LPAR3LPAR1LPAR2 | |
| SCHEMBL19602981 | 0.91 | LPAR3 (0.55) | CYP3A4LPAR3LPAR1LPAR2 | |
| Acetonitrile SCHEMBL28429990 | 0.77 | CYP3A4 (0.77) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL29148028 | 0.77 | CYP3A4 (0.56) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL29208279 | 0.77 | CYP3A4 (0.68) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL28411549 | 0.76 | CYP3A4 (0.54) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL6486 | 0.75 | ACHE (0.54) | TSHRACHE | |
| Water SCHEMBL11499396 | 0.75 | CYP3A4 (0.94) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| Water SCHEMBL28822258 | 0.75 | CYP3A4 (0.94) | CYP3A4LPAR3LPAR1LPAR2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4138553-A | 3-Methylene cephalosporanic acid derivatives and process for preparation thereof | TEIJIN LIMITED (JP) | 1979-02-06 | — | — | US | disclosed |