Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHB4 | P54760 | 7/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | RPA1 | P27694 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25694241 | 0.86 | ABL1 (0.40) | EPHB4ABL1PTGS2PTGS1ALDH1A1 | |
| SCHEMBL4533683 | 0.83 | AHR (0.56) | ABL1ALDH1A1CYP3A4TSHRMAPK1 | |
| SCHEMBL25694247 | 0.83 | HSD17B1 (0.37) | EPHB4PTGS2PTGS1ALDH1A1MAPK1 | |
| SCHEMBL10151048 | 0.79 | ALAD (0.52) | ADORA2AADORA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL12465675 | 0.77 | ALAD (0.50) | ADORA2AADORA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL12466215 | 0.75 | ALDH1A1 (0.47) | PTGS2PTGS1ALDH1A1CYP3A4 | |
| SCHEMBL23539914 | 0.74 | TAAR1 (0.47) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL12466012 | 0.73 | TAAR1 (0.46) | ALDH1A1 | |
| SCHEMBL1801175 | 0.72 | MPL (0.63) | EPHB4ABL1ALDH1A1CYP3A4 | |
| SCHEMBL16545009 | 0.70 | MAOA (0.52) | ADORA2AADORA1PTGS2PTGS1ERCC1 |
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-2023122494-A1 | COMPOSITIONS AND METHODS OF USE TO TREAT 12-LIPOXYGENASE (12-LOX) MEDIATED DISEASES | VERALOX THERAPEUTICS (US) | 2023-06-29 | — | — | WO | disclosed |