Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.56 |
| ▸ | PPARG | P37231 | 2/20 | 0.56 |
| ▸ | MMP8 | P22894 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPY1R | P25929 | 1/20 | 0.46 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 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 | |
|---|---|---|---|---|
| SCHEMBL10521821 | 0.87 | MMP8 (0.61) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL7430046 | 0.86 | EPHX2 (0.55) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL7432536 | 0.85 | SMN1; SMN2 (0.53) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL7425814 | 0.85 | PPARG (0.54) | EPHX2PPARGMMP8MEN1NPC1 | |
| Hydrochloric Acid SCHEMBL10738623 | 0.84 | SMN1; SMN2 (0.52) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL23699326 | 0.84 | EPHX2 (0.56) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL15479082 | 0.83 | PPARG (0.58) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL3504311 | 0.83 | EPHX2 (0.70) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL3184765 | 0.82 | PPARG (0.57) | EPHX2PPARGMMP8MEN1NPC1 | |
| SCHEMBL17995281 | 0.82 | CYP1A2 (0.68) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0061745-A1 | Tetrahydroisoquinoline compounds, processes for preparation thereof and pharmaceutical composition containing them | Tanabe Seiyaku Co., Ltd. (JP) | 1982-10-06 | — | — | EP | disclosed |