Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRAP1 | Q12931 | 6/20 | 0.36 |
| ▸ | HSP90B1 | P14625 | 4/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | SPR | P35270 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PPIA | P62937 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.33 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL25248972 | 1.00 | TRAP1 (0.36) | TRAP1HSP90B1BRD4NAMPTHSP90AA1 | |
| SCHEMBL25253974 | 0.88 | TGM2 (0.39) | TRAP1HSP90B1BRD4NAMPTSLC5A1 | |
| SCHEMBL30970470 | 0.88 | TGM2 (0.39) | TRAP1HSP90B1BRD4NAMPTSLC5A1 | |
| SCHEMBL29168554 | 0.88 | BRD4 (0.49) | TRAP1HSP90B1BRD4 | |
| SCHEMBL30970496 | 0.86 | GLRA1 (0.35) | TRAP1HSP90B1HSP90AA1SPRALDH1A1 | |
| SCHEMBL25211585 | 0.86 | GLRA1 (0.35) | TRAP1HSP90B1HSP90AA1SPRALDH1A1 | |
| SCHEMBL24913934 | 0.86 | TRAP1 (0.41) | TRAP1HSP90B1BRD4HSP90AA1L3MBTL1 | |
| SCHEMBL30789151 | 0.86 | TRAP1 (0.41) | TRAP1HSP90B1BRD4HSP90AA1L3MBTL1 | |
| SCHEMBL24913881 | 0.81 | TRAP1 (0.51) | TRAP1HSP90B1HSP90AA1L3MBTL1SPR | |
| SCHEMBL30156809 | 0.81 | TRAP1 (0.51) | TRAP1HSP90B1HSP90AA1L3MBTL1SPR |
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 |
|---|---|---|---|---|---|---|---|
| CN-118317949-A | Isoindolines as PMS2 inhibitors | 奈奥芬莱有限公司 | 2024-07-09 | — | — | CN | claimed |
| CN-118317949-A | Isoindolines as PMS2 inhibitors | 奈奥芬莱有限公司 | 2024-07-09 | — | — | CN | disclosed |