Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY4 | P51582 | 7/20 | 0.69 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.56 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.56 |
| ▸ | GNG2 | P59768 | 2/20 | 0.54 |
| ▸ | GNB1 | P62873 | 2/20 | 0.54 |
| ▸ | P2RY12 | Q9H244 | 7/20 | 0.53 |
| ▸ | PLAUR | Q03405 | 2/20 | 0.53 |
| ▸ | P2RY2 | P41231 | 6/20 | 0.53 |
| ▸ | P2RY6 | Q15077 | 4/20 | 0.53 |
| ▸ | CDK2 | P24941 | 2/20 | 0.53 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.53 |
| ▸ | ENTPD1 | P49961 | 2/20 | 0.52 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.52 |
| ▸ | MET | P08581 | 2/20 | 0.51 |
| ▸ | HGF | P14210 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11172913 | 0.88 | P2RY4 (0.65) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL19359475 | 0.88 | PLAUR (0.69) | P2RY4GNG2GNB1P2RY12PLAUR | |
| SCHEMBL11120841 | 0.86 | P2RY4 (0.68) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL11337879 | 0.86 | GNG2 (0.67) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL7630900 | 0.84 | P2RY4 (0.68) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL19382542 | 0.83 | P2RY4 (0.50) | P2RY4NTRK1NTRK2GNG2GNB1 | |
| SCHEMBL13214019 | 0.83 | P2RY4 (0.80) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL7949815 | 0.83 | P2RY4 (0.69) | P2RY4GNG2GNB1P2RY12P2RY2 | |
| SCHEMBL7944836 | 0.82 | P2RY4 (0.56) | P2RY4GNG2GNB1P2RY12PLAUR | |
| SCHEMBL3016037 | 0.82 | P2RY4 (0.78) | P2RY4GNG2GNB1P2RY12P2RY2 |
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-2017161235-A1 | PROCESS FOR PREPARING SUBSTITUTED 9,10-DIOXO-9,10-DIOXO-9,10-DIHYDROANTHRECENES AND 6H-ANTHRA(1,9-CD)ISOXAZOL-6-ONES | PURDUE PHARMA L. P. (US) | 2017-09-21 | — | — | WO | disclosed |