Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | NPY2R | P49146 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | PPID | Q08752 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27874903 | 0.94 | MMP8 (0.67) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL7386752 | 0.84 | CYP3A4 (0.51) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL5496491 | 0.83 | CYP3A4 (0.50) | MMP8CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL5496496 | 0.83 | CYP3A4 (0.50) | MMP8CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL5495922 | 0.82 | GPR142 (0.52) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL5495924 | 0.82 | GPR142 (0.52) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL9560816 | 0.82 | ALDH1A1 (0.50) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL14503218 | 0.80 | MMP8 (0.70) | MMP8CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL7361284 | 0.80 | LAP3 (0.64) | MMP8CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL27546532 | 0.80 | LAP3 (0.64) | MMP8CYP3A4CYP2D6CYP2C19POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-102712640-A | Tricyclic heterocyclic compounds, compositions and methods of use thereof | HOFFMANN LA ROCHE | 2012-10-03 | — | — | CN | disclosed |