Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | TYR | P14679 | 1/20 | 0.60 |
| ▸ | CA7 | P43166 | 1/20 | 0.60 |
| ▸ | CA9 | Q16790 | 1/20 | 0.60 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.60 |
| ▸ | BACE1 | P56817 | 1/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.53 |
| ▸ | TTR | P02766 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.52 |
| ▸ | P4HB | P07237 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | KDM5A | P29375 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9380189 | 1.00 | CA12 (0.60) | CA12CA1CA2TYRCA7 | |
| SCHEMBL7086909 | 0.90 | ALOX5 (0.66) | BACE1ALOX5PTGS1PTGS2TTR | |
| SCHEMBL7086903 | 0.90 | ALOX5 (0.66) | BACE1ALOX5PTGS1PTGS2TTR | |
| SCHEMBL7091402 | 0.89 | P2RX3 (0.57) | BACE1ALOX5PTGS1PTGS2ABCG2 | |
| SCHEMBL7091399 | 0.89 | P2RX3 (0.57) | BACE1ALOX5PTGS1PTGS2ABCG2 | |
| SCHEMBL23273749 | 0.86 | ALOX5 (0.58) | BACE1ALOX5PTGS1PTGS2ABCG2 | |
| SCHEMBL9380269 | 0.84 | KDM4E (0.59) | CA12CA1CA2TYRCA7 | |
| SCHEMBL9380275 | 0.84 | KDM4E (0.59) | CA12CA1CA2TYRCA7 | |
| SCHEMBL9387783 | 0.84 | ALOX5 (0.66) | BACE1ALOX5PTGS1PTGS2ABCG2 | |
| SCHEMBL9387791 | 0.84 | ALOX5 (0.66) | BACE1ALOX5PTGS1PTGS2ABCG2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0436199-B1 | Cyclopropyl derivative lipoxygenase inhibitors | ABBOTT LAB (US) | 1994-08-03 | — | — | EP | disclosed |
| US-5120752-A | N-(1-(20(3-pyridyloxy)phenyl)cyclopropyl) alkyl-N-hydroxyurea compounds, antiinflammatory agents | ABBOTT LABORATORIES (US) | 1992-06-09 | — | — | US | disclosed |