Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 13/20 | 0.45 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | PRKCG | P05129 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | ROS1 | P08922 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30928059 | 1.00 | PARP1 (0.45) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL30928025 | 0.84 | PARP1 (0.41) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL29223268 | 0.84 | PARP1 (0.41) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL30273141 | 0.79 | PARP1 (0.66) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL29223267 | 0.76 | PARP1 (0.36) | PARP1PDE9A | |
| SCHEMBL30928021 | 0.76 | PARP1 (0.36) | PARP1PDE9A | |
| SCHEMBL30273110 | 0.75 | PARP1 (0.62) | PARP1MAP4K4CSF1RTAOK1MKNK2 | |
| SCHEMBL29223249 | 0.74 | PARP1 (0.41) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL30928154 | 0.74 | PARP1 (0.41) | PARP1CDC7PLK4AURKAMAPK13 | |
| SCHEMBL30928050 | 0.73 | PARP1 (0.71) | PARP1CDC7PLK4AURKAMAPK13 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118084916-A | Tri-heterocyclic compounds and uses thereof | 成都赜灵生物医药科技有限公司 | 2024-05-28 | — | — | CN | disclosed |