Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FADS1 | O60427 | 1/20 | 0.64 |
| ▸ | TEK | Q02763 | 1/20 | 0.58 |
| ▸ | EGFR | P00533 | 4/20 | 0.57 |
| ▸ | FLT1 | P17948 | 1/20 | 0.56 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.53 |
| ▸ | AURKA | O14965 | 3/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.45 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 6/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.44 |
| ▸ | KIF5B | P33176 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13434856 | 0.83 | FADS1 (0.59) | FADS1TEKEGFRFLT1PIP4K2C | |
| SCHEMBL13434893 | 0.82 | FADS1 (0.58) | FADS1TEKEGFRFLT1PIP4K2C | |
| SCHEMBL5369046 | 0.79 | EGFR (0.60) | FADS1TEKEGFRFLT1PIP4K2C | |
| SCHEMBL3948280 | 0.78 | FADS1 (1.00) | FADS1TEKEGFRFLT1PIP4K2C | |
| SCHEMBL7886524 | 0.76 | EGFR (0.54) | FADS1TEKEGFRFLT1PIP4K2C | |
| SCHEMBL7892303 | 0.76 | FADS1 (0.54) | FADS1TEKEGFRFLT1 | |
| SCHEMBL7890179 | 0.75 | EGFR (0.55) | FADS1TEKEGFRKDR | |
| Hydrochloric Acid SCHEMBL7890170 | 0.75 | EGFR (0.53) | FADS1TEKEGFRFLT1PIP4K2C | |
| Hydrochloric Acid SCHEMBL7890107 | 0.75 | FADS1 (0.53) | FADS1TEKEGFRFLT1 | |
| SCHEMBL5455935 | 0.75 | EGFR (0.62) | FADS1TEKEGFRFLT1PIP4K2C |
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-2017040459-A1 | IMPROVED SOLUBILITY FOR TARGET COMPOUNDS | Aunova Medchem LLC (US) | 2017-03-09 | — | — | WO | disclosed |