Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 11/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 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 | |
|---|---|---|---|---|
| SCHEMBL12704713 | 0.92 | PTGS1 (0.41) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL14112006 | 0.85 | PTGS1 (0.43) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL6009746 | 0.84 | PTGS1 (0.43) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL14286748 | 0.84 | PTGS1 (0.43) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL14112380 | 0.83 | PTGS1 (0.61) | PTGS1NR1H3PTPN1 | |
| SCHEMBL12704714 | 0.82 | PTGS1 (0.47) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL14286758 | 0.82 | PTGS1 (0.47) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL280299 | 0.82 | PTGS1 (0.41) | PTGS1NR1H3PTPN1 | |
| SCHEMBL14286757 | 0.82 | PTGS1 (0.41) | PTGS1NR1H3PTPN1NR1H2 | |
| SCHEMBL12704628 | 0.81 | PTGS1 (0.62) | PTGS1NR1H3PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8133915-B2 | Interleukin-1 and tumor necrosis factor-α modulators; syntheses of such modulators and methods of using such modulators | NEREUS PHARMACEUTICALS, INC. (US) | 2012-03-13 | — | — | US | disclosed |