Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 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 | |
|---|---|---|---|---|
| SCHEMBL11916149 | 0.81 | SLC6A2 (0.38) | KDM4EALDH1A1MAPTHTTSLC6A2 | |
| SCHEMBL23067934 | 0.77 | TAAR1 (0.32) | DPP4 | |
| SCHEMBL24533487 | 0.74 | KDM4E (0.36) | KDM4EALDH1A1MAPTHTTSLC6A2 | |
| SCHEMBL9561822 | 0.73 | SLC6A2 (0.36) | KDM4EALDH1A1MAPTHTTSLC6A2 | |
| Hydrochloric Acid SCHEMBL7484049 | 0.71 | LMNA (0.37) | ALDH1A1SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL27494903 | 0.71 | MAPT (0.40) | DPP4KDM4EALDH1A1MAPTHTT | |
| SCHEMBL27494904 | 0.71 | MAPT (0.40) | DPP4KDM4EALDH1A1MAPTHTT | |
| SCHEMBL13488479 | 0.70 | SLC6A2 (0.32) | KDM4EALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11916151 | 0.68 | KDM4E (0.31) | KDM4EALDH1A1MAPTHTTSLC6A2 | |
| SCHEMBL448336 | 0.67 | ALDH1A1 (0.39) | KDM4EALDH1A1MAPTCA12CA1 |
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-2022261473-A1 | PROTEASE INHIBITORS FOR THE TREATMENT OF CORONAVIRUS INFECTIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2022-12-15 | — | — | WO | disclosed |