Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | DAGLA | Q9Y4D2 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23210224 | 0.94 | BCHE (0.37) | RORCLMNAMAPK1BCHEACHE | |
| SCHEMBL29843880 | 0.94 | BCHE (0.37) | RORCLMNAMAPK1BCHEACHE | |
| SCHEMBL23212930 | 0.81 | ALDH1A1 (0.36) | LMNAMAPK1GAAMEN1KMT2A | |
| SCHEMBL29691204 | 0.79 | KCNK3 (0.38) | GAAHTTALDH1A1FFAR4 | |
| SCHEMBL23210230 | 0.79 | KCNK3 (0.38) | GAAHTTALDH1A1FFAR4 | |
| SCHEMBL23212912 | 0.77 | KEAP1 (0.42) | LMNAALDH1A1FFAR4 | |
| SCHEMBL25817316 | 0.77 | GAA (0.41) | MAPK1GAAMEN1KMT2AVDR | |
| SCHEMBL5640238 | 0.76 | CA12 (0.43) | RORCLMNAMAPK1BCHEACHE | |
| SCHEMBL23209991 | 0.76 | LMNA (0.48) | LMNAMAPK1ALDH1A1 | |
| SCHEMBL23213647 | 0.75 | KEAP1 (0.42) | LMNAALDH1A1FFAR4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021070090-A1 | 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS | NOVARTIS AG (CH) | 2021-04-15 | — | — | WO | disclosed |