Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633967 | 0.82 | LRRK2 (0.58) | PTGS2PTGS1LRRK2KDM4ECYP3A4 | |
| SCHEMBL8631098 | 0.81 | CCNE2 (0.44) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL8629112 | 0.81 | PTGS1 (0.44) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL7780596 | 0.81 | MAOA (0.48) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL8635076 | 0.79 | PTGS2 (0.41) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL8632688 | 0.79 | GYS1 (0.58) | PTGS2PTGS1LRRK2F10MAPT | |
| SCHEMBL8631595 | 0.78 | GYS1 (0.48) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL8635017 | 0.77 | GYS1 (0.47) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL8627791 | 0.76 | PTGS1 (0.42) | PTGS2PTGS1LRRK2F10CA12 | |
| SCHEMBL8629956 | 0.75 | PTGS2 (0.37) | PTGS2PTGS1F10CA12CA1 |
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-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |