Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.30 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.30 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.30 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL8200029 | 0.88 | XDH (0.39) | RPS6KA3MAPK1NPSR1MAPK13MAPK12 | |
| SCHEMBL8637992 | 0.82 | MAPK14 (0.46) | RPS6KA3MAPK1NPSR1MAPK13MAPK12 | |
| SCHEMBL8194840 | 0.78 | MAPT (0.37) | MAPK1NPSR1MAPK14 | |
| SCHEMBL8196956 | 0.75 | CA2 (0.36) | — | |
| SCHEMBL8199102 | 0.73 | ALDH1A1 (0.36) | — | |
| SCHEMBL8196073 | 0.67 | ENPP1 (0.35) | RPS6KA3MAPK1NPSR1MAPK14 | |
| SCHEMBL8201330 | 0.66 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL8640165 | 0.66 | RPS6KA3 (0.33) | RPS6KA3MAPK1NPSR1 | |
| SCHEMBL8201683 | 0.64 | MAPK14 (0.44) | RPS6KA3MAPK1NPSR1MAPK13MAPK12 | |
| SCHEMBL8195581 | 0.63 | LMNA (0.39) | RPS6KA3MAPK1NPSR1MAPK13MAPK12 |
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 |