Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEK2 | P51955 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12473466 | 0.81 | TSHR (0.36) | — | |
| SCHEMBL9851649 | 0.65 | NEK2 (0.33) | NEK2 | |
| Hydrochloric Acid SCHEMBL2496395 | 0.62 | NEK2 (0.35) | NEK2SIGMAR1DRD2 | |
| SCHEMBL1630318 | 0.60 | NEK2 (0.36) | NEK2 | |
| SCHEMBL17113583 | 0.58 | HSD17B10 (0.34) | NEK2 | |
| SCHEMBL13282119 | 0.56 | NEK2 (0.46) | NEK2 | |
| SCHEMBL30893543 | 0.55 | — | — | |
| SCHEMBL1373550 | 0.55 | OPRM1 (0.38) | NEK2 | |
| SCHEMBL15416446 | 0.55 | NEK2 (0.35) | NEK2SIGMAR1DRD2 | |
| SCHEMBL10068052 | 0.53 | NEK2 (0.38) | NEK2 |
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-1910364-B1 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK SHARP & DOHME (US) | 2012-03-21 | — | — | EP | claimed |