Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.46 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | STAT3 | P40763 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30301742 | 0.93 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1HSP90B1ALDH1A1STAT3 | |
| SCHEMBL25221649 | 0.91 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1HSP90B1ALDH1A1STAT3 | |
| SCHEMBL25248403 | 0.89 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1HSP90B1ALDH1A1STAT3 | |
| SCHEMBL29263207 | 0.85 | LMNA (0.40) | HSP90AA1HSP90AB1ALDH1A1STAT3KDM4E | |
| SCHEMBL25201795 | 0.83 | P2RX7 (0.37) | HSP90AA1HSP90AB1ALDH1A1KDM4EMEN1 | |
| SCHEMBL25228227 | 0.81 | BDKRB1 (0.35) | HSP90AA1HSP90AB1BDKRB1HTR6 | |
| SCHEMBL30462396 | 0.79 | CA1 (0.36) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL25228631 | 0.79 | CA1 (0.36) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL30301565 | 0.78 | HSP90AA1 (0.62) | HSP90AA1HSP90AB1HSP90B1ALDH1A1KDM4E | |
| SCHEMBL30368050 | 0.77 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1HSP90B1ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-4157463-A1 | INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT | Neophore Limited (GB) | 2023-04-05 | — | — | EP | disclosed |