Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7768583 | 0.89 | CYP3A4 (0.53) | CYP3A4 | |
| SCHEMBL25284051 | 0.84 | CYP3A4 (0.47) | CYP3A4 | |
| SCHEMBL19904733 | 0.83 | CYP3A4 (0.53) | TSHRCYP3A4 | |
| SCHEMBL27042296 | 0.82 | KMT2A (0.50) | CYP3A4 | |
| SCHEMBL3234331 | 0.82 | CYP3A4 (0.46) | CYP3A4 | |
| SCHEMBL3229774 | 0.82 | CYP3A4 (0.46) | CYP3A4 | |
| SCHEMBL124571 | 0.81 | CYP3A4 (0.55) | CYP3A4 | |
| SCHEMBL31169485 | 0.81 | CYP3A4 (0.47) | CYP3A4 | |
| SCHEMBL16023560 | 0.80 | KMT2A (0.58) | — | |
| Triphenyl Phosphate SCHEMBL7526391 | 0.80 | CYP3A4 (0.53) | CYP3A4 |
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-2097428-B1 | BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | MGP BIOTECHNOLOGIES INC (US) | 2018-02-28 | — | — | EP | disclosed |