Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 4/20 | 0.34 |
| ▸ | MMP3 | P08254 | 2/20 | 0.34 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30970491 | 0.87 | KCNA1 (0.36) | HSP90AA1AVPR1BALDH1A1RECQLHPGD | |
| SCHEMBL30970490 | 0.85 | TRAP1 (0.33) | HSP90AA1AVPR1BMEN1GAAKMT2A | |
| SCHEMBL30368417 | 0.83 | HSP90AA1 (0.44) | HSP90AA1CA2ALDH1A1KDM4ETDP1 | |
| SCHEMBL30970484 | 0.80 | TRAP1 (0.32) | AVPR1BMEN1POLBGAAKMT2A | |
| SCHEMBL30368050 | 0.76 | HSP90AA1 (0.46) | HSP90AA1CA2ALDH1A1KDM4ENAMPT | |
| SCHEMBL30970485 | 0.74 | HSP90AA1 (0.33) | HSP90AA1ALDH1A1KDM4EMEN1GAA | |
| SCHEMBL30970486 | 0.74 | HSP90AA1 (0.33) | HSP90AA1ALDH1A1KDM4EMEN1GAA | |
| SCHEMBL30368298 | 0.74 | HSP90AA1 (0.42) | HSP90AA1CA2NAMPT | |
| SCHEMBL31281629 | 0.73 | NR1H2 (0.41) | HSP90AA1NR1H2PDK2MMP8MMP3 | |
| SCHEMBL25214950 | 0.73 | ALDH1A1 (0.39) | HSP90AA1MMP8MMP3CA1CA2 |
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-118317949-A | Isoindolines as PMS2 inhibitors | 奈奥芬莱有限公司 | 2024-07-09 | — | — | CN | disclosed |