Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 15/20 | 0.52 |
| ▸ | PPARA | Q07869 | 15/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11356894 | 0.84 | PPARA (0.56) | PPARGPPARAMEN1KMT2AHPGD | |
| SCHEMBL11355573 | 0.77 | CYP3A4 (0.50) | CYP3A4CYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL11806845 | 0.75 | PPARA (0.50) | PPARGPPARACYP3A4CYP1A2CYP2C19 | |
| SCHEMBL11804116 | 0.75 | PPARA (0.50) | PPARGPPARACYP3A4CYP1A2CYP2C19 | |
| SCHEMBL18055529 | 0.74 | PPARA (0.56) | PPARGPPARA | |
| SCHEMBL21882677 | 0.74 | MEN1 (0.46) | PPARGPPARAMEN1KMT2APOLB | |
| SCHEMBL14664121 | 0.74 | FDPS (0.50) | CYP3A4CYP1A2CYP2C9MEN1CHRM1 | |
| SCHEMBL28171714 | 0.73 | PPARA (0.54) | PPARGPPARA | |
| SCHEMBL11367334 | 0.72 | FDPS (0.49) | CYP3A4CYP1A2CYP2C9MEN1CHRM1 | |
| SCHEMBL17173877 | 0.72 | CYP1A2 (0.49) | CYP3A4CYP1A2CYP2C9KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4262000-A | CONTAINING ETHER AND KETONE OR HYDROXYL GROUPS | BAYER AKTIENGESELLSCHAFT (DE) | 1981-04-14 | — | — | US | disclosed |
| EP-0016974-A1 | 3-Substituted pyridine derivatives, process for their preparation, their use as fungicides, and intermediates | BAYER AG (DE) | 1980-10-15 | — | — | EP | disclosed |