Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 6/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.45 |
| ▸ | MTOR | P42345 | 4/20 | 0.45 |
| ▸ | AURKA | O14965 | 5/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.39 |
| ▸ | KDR | P35968 | 7/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 6/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 6/20 | 0.38 |
| ▸ | RET | P07949 | 4/20 | 0.38 |
| ▸ | EGFR | P00533 | 3/20 | 0.38 |
| ▸ | EPHB2 | P29323 | 2/20 | 0.38 |
| ▸ | PLK4 | O00444 | 4/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.38 |
| ▸ | ABL1 | P00519 | 4/20 | 0.38 |
| ▸ | FYN | P06241 | 4/20 | 0.38 |
| ▸ | CSF1R | P07333 | 4/20 | 0.38 |
| ▸ | LYN | P07948 | 4/20 | 0.38 |
| ▸ | KIT | P10721 | 4/20 | 0.38 |
| ▸ | SRC | P12931 | 4/20 | 0.38 |
| ▸ | FER | P16591 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8204658 | 0.88 | PIK3CA (0.45) | PIK3CAPIK3CDMTORKDRFGFR1 | |
| SCHEMBL8206190 | 0.81 | PIK3CD (0.43) | PIK3CAPIK3CDMTORALDH1A1 | |
| SCHEMBL8218949 | 0.81 | TSHR (0.46) | PIK3CAPIK3CDMTORAURKBMAPK1 | |
| SCHEMBL8218952 | 0.81 | NAMPT (0.46) | PIK3CAPIK3CDMTORAURKBMAPK1 | |
| SCHEMBL11926829 | 0.81 | PIK3CA (0.52) | PIK3CAPIK3CDMTORAURKBMAPK1 | |
| SCHEMBL8084637 | 0.81 | CA12 (0.45) | PIK3CAPIK3CDMTORALDH1A1ROCK2 | |
| SCHEMBL8098332 | 0.81 | PIK3CA (0.48) | PIK3CAPIK3CDMTORKDRKIT | |
| SCHEMBL8091889 | 0.80 | PIK3CA (0.48) | PIK3CAPIK3CDMTORKDRKIT | |
| SCHEMBL13948518 | 0.80 | PIK3CA (0.69) | PIK3CAPIK3CDMTOR | |
| SCHEMBL8206186 | 0.80 | RAB9A (0.45) | PIK3CAPIK3CDMTORKDRALDH1A1 |
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-2009007748-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |