Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.37 |
| ▸ | TRAP1 | Q12931 | 3/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | GUCY1B2 | O75343 | 4/20 | 0.32 |
| ▸ | GUCY1A2 | P33402 | 4/20 | 0.32 |
| ▸ | GUCY1A1 | Q02108 | 4/20 | 0.32 |
| ▸ | GUCY1B1 | Q02153 | 4/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31281765 | 0.91 | TRAP1 (0.35) | HSP90AA1HSP90AB1NAMPTTRAP1HSP90B1 | |
| SCHEMBL25599287 | 0.91 | TRAP1 (0.35) | HSP90AA1HSP90AB1NAMPTTRAP1HSP90B1 | |
| SCHEMBL25250614 | 0.88 | NAMPT (0.34) | HSP90AA1NAMPTTRAP1HSP90B1SIRT2 | |
| SCHEMBL30377606 | 0.88 | NAMPT (0.34) | HSP90AA1NAMPTTRAP1HSP90B1SIRT2 | |
| SCHEMBL25254673 | 0.87 | NAMPT (0.33) | HSP90AA1NAMPTTRAP1HSP90B1SIRT2 | |
| SCHEMBL30377635 | 0.87 | NAMPT (0.33) | HSP90AA1NAMPTTRAP1HSP90B1SIRT2 | |
| SCHEMBL25254449 | 0.86 | NAMPT (0.35) | HSP90AA1HSP90AB1NAMPTTRAP1HSP90B1 | |
| SCHEMBL30377316 | 0.86 | NAMPT (0.35) | HSP90AA1HSP90AB1NAMPTTRAP1HSP90B1 | |
| SCHEMBL31282001 | 0.86 | TRAP1 (0.36) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL25210256 | 0.85 | TRAP1 (0.36) | HSP90AA1HSP90AB1NAMPTTRAP1HSP90B1 |
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-2023094834-A1 | ISOINDOLINES AS PMS2 INHIBITORS | Neophore Limited (GB) | 2023-06-01 | — | — | WO | disclosed |