Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | RBP4 | P02753 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.33 |
| ▸ | PTGFR | P43088 | 5/20 | 0.32 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | BRD2 | P25440 | 1/20 | 0.31 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.31 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.31 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.31 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27911493 | 0.89 | DGAT1 (0.36) | DGAT1PTGDR2RBP4AAK1PTGFR | |
| SCHEMBL27911530 | 0.79 | SMN1; SMN2 (0.35) | ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL27894286 | 0.79 | DGAT1 (0.35) | DGAT1PTGDR2RBP4AAK1 | |
| SCHEMBL12614516 | 0.76 | DGAT1 (0.44) | DGAT1PTGDR2RBP4AAK1MAP2K1 | |
| SCHEMBL27911497 | 0.71 | SMN1; SMN2 (0.41) | PTGDR2RBP4AAK1NPC1RAB9A | |
| SCHEMBL244454 | 0.71 | AAK1 (0.48) | PTGDR2RBP4AAK1NPC1RAB9A | |
| SCHEMBL27698022 | 0.70 | DGAT1 (0.44) | DGAT1AAK1 | |
| SCHEMBL27893710 | 0.69 | PARP1 (0.36) | SMN1; SMN2 | |
| SCHEMBL27893711 | 0.69 | PARP1 (0.36) | SMN1; SMN2 | |
| SCHEMBL27828850 | 0.69 | RAB9A (0.38) | PTGDR2AAK1RAB9AALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-102985412-A | 3-amino-5,6-dihydro-1h-pyrazin-2-one derivatives useful for the treatement of alzheimer's disease and other forms of dementia | JANSSEN PHARMACEUTICA NV | 2013-03-20 | — | — | CN | disclosed |