Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | BUB1 | O43683 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | HCK | P08631 | 2/20 | 0.35 |
| ▸ | SRC | P12931 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.35 |
| ▸ | PRKDC | P78527 | 2/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24528657 | 1.00 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL31601053 | 0.89 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL23329532 | 0.88 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL4050540 | 0.85 | KDM4E (0.38) | HSP90AA1HSP90AB1KMT2AMEN1 | |
| SCHEMBL16446631 | 0.80 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL580658 | 0.80 | ENPP3 (0.48) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL31240726 | 0.80 | ENPP3 (0.48) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL31357866 | 0.79 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL16446729 | 0.78 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD | |
| SCHEMBL17528555 | 0.78 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1BUB1PIK3CAPIK3CD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4263539-A1 | 6-6 OR 5-6 FUSED BICYCLIC COMPOUNDS COMPRISING A PYRI(MI)DINE RING USEFUL IN THE TREATMENT OF INFECTIOUS DISEASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) | 2023-10-25 | — | — | EP | disclosed |
| WO-2022129376-A1 | 6-6 OR 5-6 FUSED BICYCLIC COMPOUNDS COMPRISING A PYRI(MI)DINE RING USEFUL IN THE|TREATMENT OF INFECTIOUS DISEASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2022-06-23 | — | — | WO | disclosed |