Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.59 |
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | MAPK14 | Q16539 | 9/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5391046 | 0.78 | NPC1 (0.52) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL2671138 | 0.76 | MAPK14 (0.70) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL17110499 | 0.72 | APP (0.67) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL19489880 | 0.72 | APP (0.52) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL17110585 | 0.72 | APP (0.55) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL27145735 | 0.72 | SOS1 (0.50) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL2671989 | 0.70 | GAA (0.51) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL12467808 | 0.70 | KDM4E (0.51) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL27669063 | 0.69 | HTT (0.46) | GAAKDM4ENPC1ALDH1A1NFKB1 | |
| SCHEMBL10547236 | 0.69 | KEAP1 (0.53) | GAANPC1ALDH1A1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0376870-A1 | A new organosilylpolyphosphoric reagent, its preparation and application to the process of synthesis of 3-carboxyquinolones or azaquinolones and their salts | CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) | 1990-07-04 | — | — | EP | disclosed |