Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | NPBWR1 | P48145 | 9/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8689437 | 0.87 | HTT (0.49) | HTTKDM4EGAAPTGS2PTGS1 | |
| SCHEMBL8689254 | 0.87 | PTGS2 (0.52) | PTGS2PTGS1NPSR1ALDH1A1LMNA | |
| SCHEMBL8639255 | 0.87 | PTGS2 (0.54) | HTTKDM4EGAAPTGS2PTGS1 | |
| SCHEMBL7059925 | 0.86 | PTGS2 (0.64) | HTTPTGS2PTGS1NPSR1ALDH1A1 | |
| SCHEMBL8693825 | 0.86 | PTGS2 (0.46) | GAAPTGS2PTGS1ALDH1A1NPBWR1 | |
| SCHEMBL8691904 | 0.85 | PTGS2 (0.49) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL8693265 | 0.84 | PTGS2 (0.52) | PTGS2PTGS1NPSR1LMNAF10 | |
| SCHEMBL8691138 | 0.83 | PTGS2 (0.50) | HTTKDM4EGAAPTGS2PTGS1 | |
| SCHEMBL8688908 | 0.82 | PTGS2 (0.43) | GAAPTGS2PTGS1CA12CA1 | |
| SCHEMBL6343036 | 0.79 | PTGS2 (0.71) | HTTKDM4EGAAPTGS2PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5760068-A | NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G.D. SEARLE & CO. (US) | 1998-06-02 | — | — | US | claimed |
| US-5760068-A | NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G.D. SEARLE & CO. (US) | 1998-06-02 | — | — | US | disclosed |
| US-5756529-A | ANTIINFLAMMATORY | G.D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |