Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | LPL | P06858 | 1/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL80820 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL11898566 | 0.89 | TP53 (0.48) | TAAR1TP53CYP3A4IDO1CYP2A6 | |
| SCHEMBL6510298 | 0.86 | CYP3A4 (0.50) | CYP3A4IDO1APPCYP1A2CYP2D6 | |
| SCHEMBL2355588 | 0.86 | CYP3A4 (0.50) | CYP3A4IDO1APPCYP1A2CYP2D6 | |
| SCHEMBL6546733 | 0.86 | TAAR1 (0.68) | TAAR1TP53CYP2A6LPLLIPG | |
| SCHEMBL7102517 | 0.84 | EGFR (0.48) | TAAR1TP53CYP3A4IDO1CYP2A6 | |
| SCHEMBL28148780 | 0.82 | TP53 (0.42) | TAAR1TP53CYP3A4IDO1CYP2A6 | |
| SCHEMBL175475 | 0.81 | LPL (0.50) | CYP3A4IDO1LPLLIPGL3MBTL1 | |
| SCHEMBL17148393 | 0.79 | TAAR1 (0.54) | TAAR1TP53CYP2A6LPLLIPG | |
| SCHEMBL17227382 | 0.79 | CYP1A2 (0.54) | TAAR1CYP3A4IDO1CYP2A6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011031934-A1 | HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2011-03-17 | — | — | WO | disclosed |