Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7998132 | 0.84 | PTGS2 (0.42) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL3842942 | 0.81 | PTGS2 (0.61) | PTGS2PPARGPPARA | |
| SCHEMBL7994632 | 0.80 | PTGS2 (0.51) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL7998381 | 0.79 | PTGS2 (0.50) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL7996168 | 0.77 | PTGS2 (0.57) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL7984449 | 0.76 | PTGS2 (0.56) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL7998114 | 0.76 | PTGS2 (0.56) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL7996240 | 0.76 | PTGS2 (0.56) | PTGS2S1PR1PPARGPPARACYP3A4 | |
| SCHEMBL6535031 | 0.74 | TSHR (0.43) | PTGS2PPARGPPARACYP3A4CYP2C9 | |
| SCHEMBL6534904 | 0.72 | PTGS2 (0.53) | PTGS2 |
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-6284918-B1 | ENZYME INHIBITORS | VANDERBILT UNIVERSITY | 2001-09-04 | — | — | US | disclosed |