Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KMO | O15229 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL8196138 | 0.93 | PTGS2 (0.36) | PTGS2PTGS1MEN1HTTKMT2A | |
| SCHEMBL8200073 | 0.86 | FFAR1 (0.35) | NEK1FFAR1PLK4MAPT | |
| SCHEMBL8187580 | 0.85 | TP53 (0.37) | PTGS2PTGS1NEK1MEN1KMT2A | |
| SCHEMBL8188126 | 0.83 | MEN1 (0.40) | PTGS2PTGS1MEN1HTTKMT2A | |
| SCHEMBL8201788 | 0.83 | IDO1 (0.37) | PTGS2NEK1MEN1HTTKMT2A | |
| SCHEMBL8196169 | 0.83 | ALDH1A1 (0.37) | PTGS2PTGS1MEN1KMT2AKMO | |
| SCHEMBL8196142 | 0.83 | PTGS2 (0.37) | PTGS2PTGS1MAPT | |
| SCHEMBL8068397 | 0.82 | PTGS2 (0.53) | PTGS2 | |
| SCHEMBL8195877 | 0.76 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL8196136 | 0.76 | PTGS2 (0.38) | PTGS2RORCPTGS1FFAR1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |