Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4012148 | 0.73 | DHFR (0.46) | P2RX3GAAALDH1A1MAPTHPGD | |
| SCHEMBL4008974 | 0.71 | P2RX3 (0.35) | P2RX3GAAALDH1A1MAPTHPGD | |
| SCHEMBL4011092 | 0.64 | FGFR1 (0.48) | DHFR | |
| SCHEMBL6963018 | 0.63 | TAAR1 (0.66) | DHFRHCRTR1HCRTR2FFAR4 | |
| Hydrochloric Acid SCHEMBL14157348 | 0.62 | TAAR1 (0.64) | DHFRFFAR4 | |
| SCHEMBL12881236 | 0.61 | ALOX5 (0.49) | P2RX3DHFRFFAR4 | |
| SCHEMBL4012249 | 0.61 | TAAR1 (0.54) | DAODHFR | |
| SCHEMBL1416835 | 0.60 | CYP4F2 (0.56) | P2RX3ALDH1A1DHFRSMN1; SMN2FFAR4 | |
| SCHEMBL8053575 | 0.60 | FFAR4 (0.49) | P2RX3GAAALDH1A1DHFRSMN1; SMN2 | |
| SCHEMBL14486728 | 0.60 | DHFR (0.46) | P2RX3ALDH1A1DHFRADRA1DADRA1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2044063-A1 | PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | Astra Zeneca AB (SE) | 2009-04-08 | — | — | EP | disclosed |
| WO-2008001070-A1 | PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2008-01-03 | — | — | WO | disclosed |