Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9182977 | 0.85 | TAAR1 (0.44) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL23877804 | 0.85 | ALDH1A1 (0.47) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL1018494 | 0.82 | PTPN1 (0.47) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL3663320 | 0.82 | PTPN1 (0.47) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL6451619 | 0.82 | ALDH1A1 (0.52) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL28784114 | 0.81 | PTPN1 (0.46) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL22231145 | 0.81 | PTPN1 (0.46) | PTPN1ALDH1A1CDC25BCASP6RCE1 | |
| SCHEMBL7532562 | 0.81 | ALDH1A1 (0.48) | PTPN1ALDH1A1SMN1; SMN2AGTR1AGTR2 | |
| SCHEMBL27584465 | 0.80 | HSP90AB1 (0.43) | ALDH1A1KDM4ESMN1; SMN2KLKB1HDAC3 | |
| SCHEMBL27741358 | 0.79 | ACMSD (0.46) | PTPN1ALDH1A1CDC25BCASP6RCE1 |
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-2829539-B1 | New pyrrole derivatives, method of preparing same and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2016-12-21 | — | — | EP | disclosed |
| EP-2829539-A1 | New pyrrole derivatives, method of preparing same and pharmaceutical compositions containing them | Les Laboratoires Servier (FR) | 2015-01-28 | — | — | EP | disclosed |