Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL368840 | 0.68 | ALDH1A1 (0.37) | KMT2AALDH1A1MAPTMAPK1L3MBTL1 | |
| SCHEMBL367874 | 0.66 | TP53 (0.31) | ALDH1A1 | |
| SCHEMBL367884 | 0.61 | KDM4E (0.39) | KMT2AALDH1A1MAPTMAPK1L3MBTL1 | |
| SCHEMBL19328808 | 0.56 | ERN1 (0.55) | MEN1KMT2AMAPTL3MBTL1 | |
| SCHEMBL873514 | 0.55 | KDM4E (0.50) | MEN1KMT2AALDH1A1MAPTL3MBTL1 | |
| SCHEMBL2721939 | 0.52 | ALDH1A1 (0.55) | MEN1KMT2AALDH1A1MAPTMAPK1 | |
| SCHEMBL11642810 | 0.51 | ALDH1A1 (0.44) | ERCC1FEN1ERCC4MEN1KMT2A | |
| SCHEMBL7489462 | 0.51 | EGFR (0.52) | MEN1KMT2AALDH1A1MAPTMAPK1 | |
| SCHEMBL27577897 | 0.51 | ERCC1 (0.44) | ERCC1FEN1ERCC4MEN1KMT2A | |
| SCHEMBL20773225 | 0.50 | MAPT (0.45) | MEN1KMT2AALDH1A1MAPTL3MBTL1 |
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-2012009227-A1 | NOVEL DIHYDROPYRIDIN-2(1H)-ONE COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS AND NEUROKININ-3 RECEPTOR ANTAGONISTS | N30 PHARMACEUTICALS, LLC (US) | 2012-01-19 | — | — | WO | disclosed |