Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Formic Acid Methyl Ester SCHEMBL27581498 | 0.86 | NFE2L2 (0.42) | ACHEALDH1A1NFE2L2GAARELA | |
| Methoxymethane SCHEMBL27488985 | 0.84 | ACHE (0.83) | ACHEALDH1A1TSHRNFE2L2GAA | |
| O-Xylene SCHEMBL27650445 | 0.84 | TSHR (0.56) | ACHEALDH1A1TSHRLMNARAB9A | |
| Formic Acid SCHEMBL27295959 | 0.82 | ACHE (0.71) | ACHEALDH1A1TSHRNFE2L2GAA | |
| SCHEMBL27329631 | 0.82 | ACHE (0.71) | ACHEALDH1A1TSHRNFE2L2GAA | |
| Formamide SCHEMBL7850207 | 0.82 | ACHE (0.71) | ACHEALDH1A1TSHRNFE2L2GAA | |
| SCHEMBL11837 | 0.81 | — | — | |
| SCHEMBL29488781 | 0.81 | — | — | |
| SCHEMBL28876175 | 0.80 | ACHE (0.56) | ACHEALDH1A1TSHRNFE2L2GAA | |
| SCHEMBL28557764 | 0.79 | ACHE (0.83) | ACHEALDH1A1TSHRNFE2L2GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103517910-B | Morpholine-spirocyclic piperidine amides as modulators of ion channels | 沃泰克斯药物股份有限公司 | 2016-12-14 | — | — | CN | disclosed |