Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7508156 | 0.79 | TAAR1 (0.44) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL2783585 | 0.75 | CYP3A4 (0.71) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL29472832 | 0.75 | CYP3A4 (0.71) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL2783507 | 0.75 | CYP3A4 (0.71) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL1472654 | 0.75 | CYP3A4 (0.71) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL1154822 | 0.75 | CYP3A4 (0.47) | CYP3A4CYP2D6HSD17B10 | |
| Dihydrocubebin SCHEMBL15775181 | 0.75 | CYP3A4 (1.00) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL6154272 | 0.75 | CYP3A4 (0.75) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| Dihydrocubebin SCHEMBL12488032 | 0.75 | CYP3A4 (1.00) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 | |
| SCHEMBL7508160 | 0.73 | GAA (0.46) | CYP3A4CYP2D6TAAR1SLC6A4SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0634408-B1 | DEPSIPEPTIDE DERIVATIVE, PRODUCTION THEREOF AND USE THEREOF | FUJISAWA PHARMACEUTICAL CO (JP) | 2002-01-02 | — | — | EP | disclosed |
| US-5514773-A | PARASITICIDES, ANTHELMINTICS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-07 | — | — | US | disclosed |
| EP-0634408-A1 | DEPSIPEPTIDE DERIVATIVE, PRODUCTION THEREOF AND USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-01-18 | — | — | EP | disclosed |