Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8519556 | 0.88 | ABCB11 (0.47) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| SCHEMBL8518459 | 0.79 | PTGS2 (0.57) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL25735 | 0.78 | PTGS2 (1.00) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL11495798 | 0.78 | PTGS2 (1.00) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| SCHEMBL10943166 | 0.77 | PTGS2 (0.78) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL9655800 | 0.77 | PTGS2 (0.97) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL43061 | 0.77 | PTGS2 (0.97) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL28350948 | 0.77 | PTGS2 (0.97) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| Zomepirac SCHEMBL7204056 | 0.76 | PTGS2 (0.95) | PTGS2ABCB11CYP1A2ALDH1A1LMNA | |
| SCHEMBL8519484 | 0.76 | ABCB11 (0.58) | PTGS2ABCB11CYP1A2ALDH1A1LMNA |
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-5952368-A | AN INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE, ANTIINFLAMMATORY AND ANALGESIC AGENTS | SYNTEX (U.S.A.) INC. (US) | 1999-09-14 | — | — | US | disclosed |