Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 5/20 | 0.54 |
| ▸ | CASP5 | P51878 | 5/20 | 0.54 |
| ▸ | CASP4 | P49662 | 4/20 | 0.54 |
| ▸ | DRD2 | P14416 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 6/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | GBA1 | P04062 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8912652 | 0.78 | CASP1 (0.58) | CASP1CASP5CASP4SLC6A4 | |
| SCHEMBL16511117 | 0.71 | GAA (0.83) | CYP2D6SMN1; SMN2GAA | |
| SCHEMBL31713941 | 0.70 | NR1H4 (0.57) | DRD2DRD3SMN1; SMN2GAAMAPT | |
| SCHEMBL16511120 | 0.70 | GAA (0.81) | CYP2D6SMN1; SMN2GAA | |
| SCHEMBL10724868 | 0.70 | ALDH1A1 (0.82) | CYP2D6SMN1; SMN2GAA | |
| SCHEMBL9755213 | 0.69 | CASP1 (0.61) | CASP1CASP5CASP4SMN1; SMN2APAF1 | |
| SCHEMBL23094939 | 0.69 | L3MBTL1 (0.60) | DRD2DRD3 | |
| SCHEMBL9689029 | 0.69 | CASP1 (0.85) | CASP1CASP5CASP4 | |
| SCHEMBL23751040 | 0.69 | PKM (0.64) | HTR1A | |
| SCHEMBL10365266 | 0.69 | CASP1 (0.71) | CASP1CASP5CASP4DRD2DRD3 |
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-1997014685-A1 | PYRIMIDINE DERIVATIVES | GYÓGYSZERKUTATÓ INTÉZET KFT (HU) | 1997-04-24 | — | — | WO | disclosed |