Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 1/20 | 0.51 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | FPR2 | P25090 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3162425 | 0.94 | EGFR (0.53) | JAK3MAPTTSHREGFRALDH1A1 | |
| SCHEMBL3164831 | 0.92 | MAPT (0.50) | JAK3MAPTTSHRNPSR1EGFR | |
| SCHEMBL3166249 | 0.92 | GAA (0.54) | JAK3DEGS1MAPTTSHREGFR | |
| SCHEMBL3170421 | 0.92 | SMN1; SMN2 (0.55) | JAK3TSHREGFRALDH1A1SMN1; SMN2 | |
| SCHEMBL3161698 | 0.91 | ALDH1A1 (0.54) | DEGS1DRD4EGFRALDH1A1SMN1; SMN2 | |
| SCHEMBL3175543 | 0.90 | EGFR (0.50) | JAK3MAPTTSHREGFRALDH1A1 | |
| SCHEMBL3162253 | 0.90 | ALDH1A1 (0.52) | MAPTNPSR1DRD4ALDH1A1SMN1; SMN2 | |
| SCHEMBL3165286 | 0.90 | USP2 (0.57) | MAPTTSHRDRD4ALDH1A1SMN1; SMN2 | |
| SCHEMBL3258722 | 0.89 | EGFR (0.46) | JAK3MAPTTSHREGFRALDH1A1 | |
| SCHEMBL3166342 | 0.88 | ALDH1A1 (0.57) | MAPTTSHREGFRALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |