Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.31 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.31 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL17757637 | 0.89 | LMNA (0.42) | LMNAALDH1A1HTTNPSR1TDP1 | |
| SCHEMBL16410606 | 0.87 | ACAT2 (0.40) | HTTKMT2AACAT2PDE7ATP53 | |
| SCHEMBL16410739 | 0.85 | KMT2A (0.39) | LMNAALDH1A1KMT2AACAT2PDE7A | |
| SCHEMBL16410824 | 0.84 | PDE7A (0.38) | ALDH1A1KMT2AACAT2PDE7ATP53 | |
| SCHEMBL16410747 | 0.84 | PDE7A (0.38) | ALDH1A1KMT2AACAT2PDE7ATP53 | |
| SCHEMBL16410622 | 0.84 | KMT2A (0.37) | ALDH1A1KMT2AACAT2PDE7ASSTR3 | |
| SCHEMBL16410792 | 0.83 | KMT2A (0.38) | KMT2AACAT2PDE7A | |
| SCHEMBL17757875 | 0.82 | GRM4 (0.39) | LMNAALDH1A1HTTNPSR1KMT2A | |
| SCHEMBL16410840 | 0.81 | ACAT2 (0.42) | LMNAHTTKMT2AACAT2MAPT | |
| SCHEMBL16410711 | 0.81 | SMN1; SMN2 (0.37) | KMT2ASLC6A2SLC6A4TP53MEN1 |
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-2015007730-A1 | SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2015-01-22 | — | — | WO | disclosed |