Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4535542 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL10654179 | 0.83 | MAPT (0.55) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL29588009 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL29588016 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL13393628 | 0.82 | MAPT (0.44) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL13832433 | 0.82 | ALDH1A1 (0.51) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL20718866 | 0.81 | ALDH1A1 (0.56) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL14243000 | 0.81 | NPC1 (0.52) | ALDH1A1GAAMAPTMAPK1KDM4E | |
| SCHEMBL14906663 | 0.81 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTMAPK1L3MBTL1 | |
| SCHEMBL14243555 | 0.80 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTMAPK1KDM4E |
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-2015127873-A1 | ARYLAMINO PYRAMIDINE COMPOUND AND APPLICATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICALLY ACCEPTABLE COMPOSITIONS PREPARED THEREFROM | 上海海雁医药科技有限公司 | 2015-09-03 | — | — | WO | disclosed |