Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CISD1 | Q9NZ45 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL17757549 | 0.90 | MEN1 (0.41) | MEN1KMT2APKMDRD2DRD4 | |
| SCHEMBL16410834 | 0.84 | ACAT2 (0.36) | MEN1KMT2ARAB9ANPC1ACAT2 | |
| SCHEMBL16410809 | 0.82 | ACAT2 (0.35) | ACAT2 | |
| SCHEMBL17757905 | 0.80 | MEN1 (0.42) | MEN1KMT2APKMDRD2DRD4 | |
| SCHEMBL17757743 | 0.79 | MEN1 (0.41) | MEN1KMT2APKMDRD2DRD4 | |
| SCHEMBL17757029 | 0.78 | MEN1 (0.41) | MEN1KMT2APKMDRD2DRD4 | |
| SCHEMBL16410721 | 0.76 | SIGMAR1 (0.33) | MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL16410778 | 0.76 | LMNA (0.38) | RAB9ANPC1LMNA | |
| SCHEMBL17757387 | 0.75 | ACAT2 (0.38) | MEN1KMT2ARAB9ANPC1TSHR | |
| SCHEMBL17758047 | 0.75 | GAA (0.39) | MEN1KMT2ARAB9ANPC1TSHR |
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 |