Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 20/20 | 0.90 |
| ▸ | TTK | P33981 | 10/20 | 0.90 |
| ▸ | AURKA | O14965 | 1/20 | 0.79 |
| ▸ | CSF1R | P07333 | 2/20 | 0.76 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.76 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.76 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.76 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.76 |
| ▸ | MTOR | P42345 | 1/20 | 0.76 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.76 |
| ▸ | ATM | Q13315 | 1/20 | 0.76 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL23625300 | 1.00 | PRKDC (0.90) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL23625297 | 1.00 | PRKDC (0.90) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL23625483 | 1.00 | PRKDC (0.90) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL23611088 | 1.00 | PRKDC (0.90) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL20358252 | 0.95 | PRKDC (1.00) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL20330484 | 0.95 | PRKDC (1.00) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL29770931 | 0.95 | PRKDC (1.00) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL20358847 | 0.95 | PRKDC (1.00) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL23625322 | 0.94 | PRKDC (0.85) | PRKDCTTKAURKACSF1RPIK3CD | |
| SCHEMBL20299415 | 0.88 | PRKDC (1.00) | PRKDCTTKAURKACSF1RPIK3CD |
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-2021136461-A1 | PURINE DERIVATIVE AND MEDICAL USE THEREOF | 成都百裕制药股份有限公司 | 2021-07-08 | — | — | WO | disclosed |