Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | PRKX | P51817 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | MST1R | Q04912 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15808401 | 0.88 | PLK4 (0.33) | PLK4CHEK1AURKADAPK3MAP4K4 | |
| SCHEMBL12215166 | 0.74 | BTK (0.38) | BTKGAA | |
| SCHEMBL4731645 | 0.73 | METAP2 (0.40) | PTK2METAP2 | |
| SCHEMBL31358108 | 0.73 | METAP2 (0.40) | PTK2METAP2 | |
| SCHEMBL15808085 | 0.72 | CCNA2 (0.39) | FGFR1MAP2K1IDO1METAP2 | |
| SCHEMBL29240288 | 0.72 | HDAC6 (0.38) | PLK4CHEK1AURKADAPK3MAP4K4 | |
| SCHEMBL28451617 | 0.71 | TSHR (0.47) | MAP2K1METAP2GAA | |
| SCHEMBL15808377 | 0.69 | METAP2 (0.44) | IDO1METAP2 | |
| SCHEMBL1995390 | 0.68 | NOS1 (0.47) | PLK4CHEK1AURKADAPK3MAP4K4 | |
| SCHEMBL12600920 | 0.68 | NOS1 (0.47) | PLK4CHEK1AURKADAPK3MAP4K4 |
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-117756793-A | 1,2, 4-heterodiazole derivatives and use thereof | 四川大学 | 2024-03-26 | — | — | CN | disclosed |