Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 19/20 | 0.59 |
| ▸ | EGFR | P00533 | 2/20 | 0.59 |
| ▸ | INSR | P06213 | 5/20 | 0.57 |
| ▸ | TTK | P33981 | 2/20 | 0.55 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | STK25 | O00506 | 1/20 | 0.55 |
| ▸ | RIOK3 | O14730 | 1/20 | 0.55 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.55 |
| ▸ | CASK | O14936 | 1/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.55 |
| ▸ | GAK | O14976 | 1/20 | 0.55 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.55 |
| ▸ | MUSK | O15146 | 1/20 | 0.55 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.55 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.55 |
| ▸ | MAP3K13 | O43283 | 1/20 | 0.55 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.55 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.55 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL21363944 | 0.87 | EGFR (0.78) | ALKEGFRINSRERBB2IGF1R | |
| Trifluoroacetic Acid SCHEMBL21358354 | 0.83 | EGFR (0.72) | ALKEGFRINSRERBB2IGF1R | |
| SCHEMBL21164698 | 0.81 | ALK (0.75) | ALKINSRROS1 | |
| SCHEMBL25001760 | 0.80 | EGFR (0.68) | ALKEGFRINSRTTKULK1 | |
| SCHEMBL30748473 | 0.80 | EGFR (0.68) | ALKEGFRINSRTTKULK1 | |
| SCHEMBL28728766 | 0.78 | ALK (0.56) | ALKEGFRINSRROS1MAPK8 | |
| SCHEMBL28728740 | 0.78 | ALK (0.61) | ALKEGFRINSRTTKBMPR1B | |
| SCHEMBL27163249 | 0.77 | ALK (0.76) | ALKEGFRINSRTTKBMPR1B | |
| SCHEMBL19027384 | 0.77 | ALK (0.82) | ALKEGFRINSRERBB2ROS1 | |
| SCHEMBL30939736 | 0.77 | EGFR (0.77) | ALKEGFRINSRROS1ZAP70 |
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-2019177375-A1 | 2, 4, 5-SUBSTITUTED PYRIMIDINE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT | 포로노이바이오 주식회사 | 2019-09-19 | — | — | WO | disclosed |