Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757521 | 0.92 | PIM1 (0.36) | PIK3CB | |
| SCHEMBL17758061 | 0.91 | ELANE (0.35) | PIK3CBHTTLMNAALDH1A1GAA | |
| SCHEMBL17757836 | 0.91 | HTT (0.38) | PIK3CBHTTLMNAALDH1A1GAA | |
| SCHEMBL17757018 | 0.90 | LMNA (0.39) | PIK3CBHTTLMNAGAASMN1; SMN2 | |
| SCHEMBL17757219 | 0.89 | ALDH1A1 (0.35) | PIK3CBHTTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL17757328 | 0.89 | POLB (0.39) | HTTLMNAALDH1A1GAASMN1; SMN2 | |
| SCHEMBL17757335 | 0.89 | MAPT (0.35) | LMNAGAA | |
| SCHEMBL17757331 | 0.89 | MAPT (0.33) | HTTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL17757111 | 0.88 | ACAT2 (0.36) | — | |
| SCHEMBL17757285 | 0.87 | ACAT2 (0.35) | — |
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 |