Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.62 |
| ▸ | LPL | P06858 | 3/20 | 0.54 |
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL327381 | 1.00 | TAAR1 (0.62) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL22223062 | 0.92 | TAAR1 (0.54) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL11566894 | 0.92 | TAAR1 (0.54) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL142480 | 0.90 | LPL (0.62) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL9664205 | 0.89 | TAAR1 (0.52) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL10747570 | 0.87 | ESR1 (0.59) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL6546733 | 0.87 | TAAR1 (0.68) | TAAR1LPLLIPGTP53CA2 | |
| SCHEMBL9839848 | 0.87 | LPL (0.59) | TAAR1LPLLIPGTP53CA2 | |
| Ethylbenzene SCHEMBL9448399 | 0.86 | TP53 (0.74) | TAAR1TP53CYP2A6ALDH1A1 | |
| SCHEMBL22360078 | 0.85 | TAAR1 (0.48) | TAAR1LPLLIPGTP53CA2 |
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-4367359-A | ISOMERIZATION, ALKYLATION | MOBIL OIL CORPORATION (US) | 1983-01-04 | — | — | US | disclosed |