Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 16/20 | 0.77 |
| ▸ | PIK3CA | P42336 | 8/20 | 0.77 |
| ▸ | MTOR | P42345 | 7/20 | 0.77 |
| ▸ | PRKDC | P78527 | 1/20 | 0.77 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.52 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.51 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.51 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.50 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.50 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.50 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3603778 | 0.89 | ATR (0.73) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL1272485 | 0.87 | ATR (1.00) | ATRPIK3CAMTORPRKDC | |
| SCHEMBL19147383 | 0.86 | ATR (0.70) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3591720 | 0.85 | ATR (0.69) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3599734 | 0.84 | ATR (0.66) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3595465 | 0.84 | ATR (0.66) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL29397370 | 0.84 | ATR (0.66) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3600426 | 0.83 | ATR (0.66) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3606344 | 0.83 | ATR (0.65) | ATRPIK3CAMTORPRKDCPIK3CD | |
| SCHEMBL3608878 | 0.83 | ATR (0.65) | ATRPIK3CAMTORPRKDCPIK3CD |
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-2017121684-A1 | 5-SUBSTITUTED 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2017-07-20 | — | — | WO | disclosed |