Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 3/20 | 0.51 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | GAK | O14976 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ABL1 | P00519 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.39 |
| ▸ | YES1 | P07947 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | HIPK1 | Q86Z02 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 4/20 | 0.38 |
| ▸ | JAK2 | O60674 | 3/20 | 0.38 |
| ▸ | TYK2 | P29597 | 2/20 | 0.38 |
| ▸ | JAK1 | P23458 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 5/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4880285 | 0.90 | NOS1 (0.66) | NOS1ADKPIK3CAPIK3CGGAK | |
| SCHEMBL3755477 | 0.85 | NOS1 (0.68) | NOS1ADKPIK3CAPIK3CGGAK | |
| SCHEMBL3755510 | 0.81 | NOS1 (0.70) | NOS1ADKPIK3CAPIK3CGGAK | |
| SCHEMBL3765571 | 0.74 | NOS1 (0.67) | NOS1PIK3CAPIK3CGMAPK1JAK2 | |
| SCHEMBL4448697 | 0.72 | NOS1 (0.63) | NOS1PIK3CAPIK3CGMAPK1JAK3 | |
| SCHEMBL4458138 | 0.71 | NOS1 (0.68) | NOS1PIK3CAPIK3CGATRLMNA | |
| SCHEMBL3755627 | 0.71 | NOS1 (0.72) | NOS1ADKPIK3CAPIK3CGGAK | |
| SCHEMBL4452271 | 0.70 | NOS1 (0.68) | NOS1PIK3CAJAK3ATR | |
| SCHEMBL3760949 | 0.69 | NOS1 (0.69) | NOS1ADKPIK3CAMAPK1JAK3 | |
| SCHEMBL4451911 | 0.69 | NOS1 (0.79) | NOS1ADKPIK3CAPIK3CGGAK |
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-2008009079-A2 | SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS | GILEAD SCIENCES, INC. (US) | 2008-01-24 | — | — | WO | disclosed |