Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 7/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28707608 | 0.87 | KDM4E (0.57) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3976142 | 0.85 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL29778164 | 0.82 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL31300305 | 0.81 | KDM4E (0.51) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL11376344 | 0.80 | KDM4E (0.54) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3977899 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3978940 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3976248 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3978947 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL3976250 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2GAAHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1620409-B1 | QUINOXALIN-3-ONE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-01-09 | — | — | EP | disclosed |
| WO-2004096780-A1 | QUINOXALINONE-3- ONE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2004-11-11 | — | — | WO | disclosed |