Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 13/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 12/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL30872169 | 0.83 | HCRTR2 (0.38) | HCRTR2HCRTR1SLC6A7 | |
| SCHEMBL31351486 | 0.82 | HCRTR1 (0.56) | HCRTR2HCRTR1 | |
| SCHEMBL30872179 | 0.81 | PKM (0.38) | HCRTR2HCRTR1USP2 | |
| SCHEMBL30872180 | 0.78 | HCRTR1 (0.43) | HCRTR2HCRTR1EGFR | |
| SCHEMBL30872176 | 0.76 | KDM4E (0.47) | HCRTR2HCRTR1ALDH1A1HTTKDM4E | |
| SCHEMBL30872175 | 0.70 | HCRTR1 (0.53) | HCRTR2HCRTR1 | |
| SCHEMBL30872153 | 0.68 | HCRTR1 (0.56) | HCRTR2HCRTR1 | |
| SCHEMBL30872161 | 0.68 | HCRTR1 (0.48) | HCRTR2HCRTR1 | |
| SCHEMBL30872171 | 0.68 | HCRTR1 (0.50) | HCRTR2HCRTR1 | |
| SCHEMBL30872186 | 0.67 | HCRTR1 (0.45) | HCRTR2HCRTR1ALDH1A1KDM4E |
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-2024109672-A1 | DISUBSTITUTED OCTAHYDROPYRROLO[3,4-C]PYRROLE METHYL KETONE DERIVATIVE AND APPLICATION THEREOF | 江苏恩华药业股份有限公司 | 2024-05-30 | — | — | WO | disclosed |