Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 16/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | ATXN2 | Q99700 | 9/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL11899132 | 0.89 | ENPP2 (0.56) | ENPP2KCNH2ATXN2 | |
| SCHEMBL11899133 | 0.89 | ENPP2 (0.56) | ENPP2KCNH2ATXN2 | |
| SCHEMBL104877 | 0.89 | ENPP2 (0.55) | ENPP2KCNH2ATXN2 | |
| SCHEMBL107531 | 0.86 | ENPP2 (0.47) | ENPP2KCNH2ATXN2HTR1ASLC6A2 | |
| SCHEMBL1671586 | 0.84 | ENPP2 (0.48) | ENPP2KCNH2ATXN2 | |
| SCHEMBL1672873 | 0.84 | ENPP2 (0.42) | ENPP2KCNH2ATXN2GRIN2DGRIN3B | |
| SCHEMBL13137773 | 0.78 | ENPP2 (0.70) | ENPP2KCNH2ATXN2 | |
| SCHEMBL13137772 | 0.78 | ENPP2 (0.70) | ENPP2KCNH2ATXN2 | |
| SCHEMBL104876 | 0.78 | ENPP2 (0.70) | ENPP2KCNH2ATXN2 | |
| SCHEMBL104770 | 0.74 | ENPP2 (0.61) | ENPP2KCNH2ATXN2 |
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-2488504-B1 | SULFOXIDE DERIVATIVES FOR TREATING TUMORS | MERCK PATENT GMBH (DE) | 2016-07-06 | — | — | EP | disclosed |
| EP-2488504-A1 | SULFOXIDE DERIVATIVES FOR TREATING TUMORS | Merck Patent GmbH (DE) | 2012-08-22 | — | — | EP | disclosed |
| WO-2011044978-A1 | SULFOXIDE DERIVATIVES FOR TREATING TUMORS | MERCK PATENT GMBH (DE) | 2011-04-21 | — | — | WO | disclosed |