Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | SCD | O00767 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3166238 | 0.90 | ALDH1A1 (0.54) | CLK4ADORA3THRBPTGDRSMN1; SMN2 | |
| SCHEMBL3171330 | 0.90 | CA1 (0.48) | TP53CLK4SMN1; SMN2 | |
| SCHEMBL3164379 | 0.89 | TP53 (0.52) | MEN1KMT2ATP53ADORA3CNR2 | |
| SCHEMBL3169166 | 0.88 | ALDH1A1 (0.49) | MEN1KMT2ATP53ADORA3CNR2 | |
| SCHEMBL3177073 | 0.88 | CYP1A2 (0.47) | MEN1KMT2ATP53ADORA3THRB | |
| SCHEMBL3170639 | 0.88 | KMT2A (0.48) | MEN1KMT2ATP53CLK4ADORA3 | |
| SCHEMBL3171746 | 0.87 | TP53 (0.49) | MEN1KMT2ATP53CLK4SCD | |
| SCHEMBL3170716 | 0.87 | MAPT (0.53) | MEN1KMT2ATP53CLK4SCD | |
| SCHEMBL3170868 | 0.87 | LMNA (0.49) | TP53ADORA3KDR | |
| SCHEMBL3177128 | 0.87 | LMNA (0.49) | TP53 |
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 |