Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | IGF1R | P08069 | 2/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | BPTF | Q12830 | 1/20 | 0.32 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757732 | 0.90 | ACAT2 (0.38) | ELANEPARP1KMT2AEGFRIGF1R | |
| SCHEMBL17757092 | 0.89 | ELANE (0.36) | ELANEPARP1KMT2AEGFRIGF1R | |
| SCHEMBL17758035 | 0.89 | ELANE (0.38) | ELANEPARP1KMT2AEGFRIGF1R | |
| SCHEMBL17757120 | 0.89 | PIM1 (0.35) | PARP1KMT2AACAT2MEN1SMN1; SMN2 | |
| SCHEMBL17757109 | 0.87 | ACAT2 (0.36) | ELANEKMT2AACAT2 | |
| SCHEMBL14398518 | 0.87 | KMT2A (0.41) | KMT2AACAT2GAAMAPT | |
| SCHEMBL17757653 | 0.87 | KMT2A (0.41) | KMT2AACAT2GAAMAPT | |
| SCHEMBL17757467 | 0.87 | KMT2A (0.41) | KMT2AACAT2GAAMAPT | |
| SCHEMBL17757255 | 0.87 | MAPK1 (0.37) | PARP1KMT2AEGFRIGF1RTDO2 | |
| SCHEMBL17757114 | 0.87 | ACAT2 (0.39) | KMT2AACAT2MEN1LMNAMAPT |
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-2016075137-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2016-05-19 | — | — | WO | disclosed |