Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | LOX | P28300 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 17/20 | 0.49 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27466225 | 0.86 | MAOA (0.49) | MAOALOXPTGS2LOXL2PTGS1 | |
| SCHEMBL7395459 | 0.74 | PTGS2 (0.74) | PTGS2PTGS1 | |
| SCHEMBL6470141 | 0.74 | PTGS2 (0.74) | PTGS2PTGS1 | |
| SCHEMBL5831675 | 0.73 | PTGS2 (0.56) | MAOAPTGS2PTGS1 | |
| SCHEMBL27709191 | 0.70 | MAOB (0.52) | LOXL2 | |
| SCHEMBL27431456 | 0.70 | PTPN5 (0.54) | PTGS2PTGS1 | |
| SCHEMBL5898253 | 0.70 | PTGS2 (0.37) | LOXPTGS2LOXL2PTGS1 | |
| SCHEMBL444872 | 0.68 | PTGS2 (0.69) | PTGS2PTGS1 | |
| SCHEMBL7935589 | 0.66 | PTGS2 (0.56) | PTGS2PTGS1 | |
| SCHEMBL7054313 | 0.66 | ALDH1A1 (0.47) | LOXLOXL2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1155600-C | 2, 3-diaryl pyrazolo [1, 5-b ] pyridazine derivatives, their preparation and their use as cyclooxygenase 2 inhibitors | — | 2004-06-30 | — | — | CN | disclosed |
| CN-1278263-A | 2,3-diaryl-pyrazolo [1,5-B] pyridazines derivatives, their prepn. and use as cyclooxygenase 2 (cox-2) inhibitors | GLAXO GROUP LTD (GB) | 2000-12-27 | — | — | CN | disclosed |