Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | MEP1B | Q16820 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | MPL | P40238 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23703226 | 0.85 | HTT (0.39) | HTTALDH1A1GAAPOLBRECQL | |
| Butane SCHEMBL8819824 | 0.83 | PGK1 (0.43) | HTTALDH1A1GAAPOLBRECQL | |
| SCHEMBL658696 | 0.81 | GAA (0.39) | ALDH1A1GAAPOLBRECQLMEP1B | |
| SCHEMBL1180196 | 0.79 | GAA (0.41) | ALDH1A1GAAPOLBRECQLMEP1B | |
| SCHEMBL30236538 | 0.79 | RAPGEF4 (0.44) | HTTALDH1A1GAAPOLBRECQL | |
| SCHEMBL14991279 | 0.79 | AMY1A (0.44) | HTTALDH1A1GAAPOLBRECQL | |
| SCHEMBL30823619 | 0.79 | GAA (0.41) | ALDH1A1GAAPOLBRECQLMEP1B | |
| SCHEMBL30716894 | 0.79 | AMY1A (0.44) | HTTALDH1A1GAAPOLBRECQL | |
| SCHEMBL1607815 | 0.79 | RAPGEF4 (0.44) | HTTALDH1A1GAAPOLBRECQL | |
| SCHEMBL1866693 | 0.79 | HTT (0.65) | HTTALDH1A1GAAPOLBMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3020720-B1 | PHOSPHONATE ESTER DERIVATIVES AND METHODS OF SYNTHESIS THEREOF | CHIMERIX INC (US) | 2018-09-19 | — | — | EP | disclosed |
| EP-3020720-A1 | PHOSPHONATE ESTER DERIVATIVES AND METHODS OF SYNTHESIS THEREOF | Chimerix, Inc. (US) | 2016-05-18 | — | — | EP | disclosed |