Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 4/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753466 | 1.00 | PTGS2 (0.34) | PTGS2PTGS1KDM5BKCNK3HTR2A | |
| SCHEMBL9753119 | 0.89 | PTGS2 (0.36) | PTGS2PTGS1KDM5BKCNK3HTR2A | |
| SCHEMBL9753686 | 0.88 | MAPK14 (0.40) | PTGS2PTGS1KDM5BKCNK3MAPK14 | |
| SCHEMBL9752990 | 0.88 | KDM5B (0.34) | PTGS2PTGS1KDM5BKCNK3MAPK14 | |
| SCHEMBL9752989 | 0.88 | KDM5B (0.34) | PTGS2PTGS1KDM5BKCNK3MAPK14 | |
| SCHEMBL9753682 | 0.88 | MAPK14 (0.40) | PTGS2PTGS1KDM5BKCNK3MAPK14 | |
| SCHEMBL9753226 | 0.87 | MAPK14 (0.39) | PTGS2PTGS1KDM5BMAPK14 | |
| SCHEMBL9753228 | 0.87 | MAPK14 (0.39) | PTGS2PTGS1KDM5BMAPK14 | |
| SCHEMBL9753316 | 0.85 | KDM5B (0.32) | PTGS2PTGS1KDM5B | |
| SCHEMBL9753389 | 0.85 | KDM5B (0.32) | PTGS2PTGS1KDM5B |
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-1991018903-A1 | PYRROLOPYRIDAZINE COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-12-12 | — | — | WO | disclosed |