Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 18/20 | 0.74 |
| ▸ | AURKA | O14965 | 1/20 | 0.57 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL29833089 | 0.90 | PTK2 (0.61) | PTK2EGFR | |
| SCHEMBL24752369 | 0.89 | AURKA (0.72) | PTK2AURKAEGFR | |
| SCHEMBL30002962 | 0.89 | AURKA (0.72) | PTK2AURKAEGFR | |
| SCHEMBL24752678 | 0.85 | PTK2 (0.69) | PTK2 | |
| SCHEMBL30184231 | 0.85 | PTK2 (0.69) | PTK2 | |
| SCHEMBL26717249 | 0.83 | INSR (0.72) | PTK2EGFR | |
| SCHEMBL29832995 | 0.82 | PTK2 (0.59) | PTK2AURKAEGFR | |
| SCHEMBL29805846 | 0.82 | CCNA2 (0.69) | PTK2EGFR | |
| SCHEMBL23533980 | 0.82 | CCNA2 (0.69) | PTK2EGFR | |
| SCHEMBL29833074 | 0.82 | MAPK9 (0.67) | PTK2EGFR |
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-2022199589-A1 | PYRIMIDINE DERIVATIVES | 南京明德新药研发有限公司 | 2022-09-29 | — | — | WO | disclosed |