Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6957812 | 0.87 | LMNA (0.39) | MEN1KMT2APRKCAGSK3BL3MBTL1 | |
| SCHEMBL6951613 | 0.85 | PGR (0.46) | MEN1KMT2AATMGAACNR2 | |
| SCHEMBL6644290 | 0.85 | MEN1 (0.41) | MEN1KMT2AATMAPEX1GAA | |
| SCHEMBL6948825 | 0.82 | MEN1 (0.46) | MEN1KMT2AATMAPEX1GAA | |
| SCHEMBL1185879 | 0.82 | MEN1 (0.63) | MEN1KMT2AATMPRKCAGSK3B | |
| SCHEMBL8119434 | 0.81 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19CYP2D6NPSR1 | |
| SCHEMBL8568029 | 0.81 | MEN1 (0.48) | MEN1KMT2AATMGAACYP1A2 | |
| SCHEMBL8567507 | 0.78 | MEN1 (0.43) | MEN1KMT2AATMPRKCAGSK3B | |
| SCHEMBL11811721 | 0.77 | APEX1 (0.50) | MEN1KMT2APRKCAGSK3BAPEX1 | |
| SCHEMBL6947807 | 0.76 | ALDH1A1 (0.47) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708101-B1 | Piperidine derivatives, useful as neurokinin receptor antagonists | ADIR (FR) | 1998-12-09 | — | — | EP | disclosed |
| US-5652246-A | NEUROKININ RECEPTOR ANTAGONISTS; NERVOUS SYSTEM DISORDERS | ADIR ET COMPAGNIE (FR) | 1997-07-29 | — | — | US | disclosed |
| EP-0708101-A1 | Novel piperidine derivatives, useful as neurokinin receptor antagonists | ADIR ET COMPAGNIE (FR) | 1996-04-24 | — | — | EP | disclosed |