Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 7/20 | 0.65 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.65 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.65 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.65 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | TTR | P02766 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.59 |
| ▸ | CA12 | O43570 | 2/20 | 0.59 |
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA3 | P07451 | 2/20 | 0.59 |
| ▸ | CA4 | P22748 | 2/20 | 0.59 |
| ▸ | CA6 | P23280 | 2/20 | 0.59 |
| ▸ | CA5A | P35218 | 2/20 | 0.59 |
| ▸ | CA7 | P43166 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL20024678 | 0.86 | ALDH1A3 (0.68) | PTGS2KDM4ECYP1A1CYP1B1LMNA | |
| SCHEMBL13630653 | 0.86 | PTGS2 (0.67) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL20929819 | 0.83 | PTGS1 (0.57) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL2470272 | 0.81 | APP (0.57) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL9605425 | 0.81 | PTGS1 (0.59) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL27224304 | 0.80 | PTGS2 (0.54) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL392666 | 0.80 | CYP1A1 (0.72) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL392667 | 0.80 | CYP1A1 (0.72) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| Resveratrol 4'-Methyl Ether SCHEMBL4732963 | 0.79 | PTGS2 (1.00) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 | |
| Resveratrol 4'-Methyl Ether SCHEMBL563262 | 0.79 | PTGS2 (1.00) | PTGS1PTGS2KDM4ECYP1A1CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013037985-A1 | PHARMACEUTICAL COMBINATIONS INCLUDING ANTI-INFLAMMATORY AND ANTIOXIDANT CONJUGATES USEFUL FOR TREATING METABOLIC DISORDERS | GENMEDICA THERAPUTICS SL (ES) | 2013-03-21 | — | — | WO | disclosed |
| WO-2009138437-A1 | SALICYLATE CONJUGATES USEFUL FOR TREATING METABOLIC DISORDERS | GENMEDICA THERAPEUTICS SL (ES) | 2009-11-19 | — | — | WO | disclosed |