Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 9/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 6/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 6/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 6/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.33 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.33 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753499 | 0.89 | MAPK14 (0.31) | ALDH1A1MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL9753497 | 0.89 | MAPK14 (0.31) | ALDH1A1MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL9753400 | 0.89 | TP53 (0.36) | ALDH1A1HTTMAPK14MAPK13MAPK12 | |
| SCHEMBL9753321 | 0.83 | MAPK14 (0.44) | ALDH1A1MAPK14EGFRRAF1ADORA3 | |
| SCHEMBL9753354 | 0.81 | PTGS2 (0.34) | ALDH1A1MAPK14EGFRRAF1ADORA3 | |
| SCHEMBL9753098 | 0.80 | GCGR (0.40) | MAPK14PRKD3MAP4K4MAPK9CSNK1D | |
| SCHEMBL9752977 | 0.79 | TP53 (0.34) | MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL9752975 | 0.79 | TP53 (0.34) | MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL9753501 | 0.79 | HMGCR (0.45) | ALDH1A1NR1I2ADORA3PTGS2 | |
| SCHEMBL9753024 | 0.78 | HMGCR (0.35) | ALDH1A1NR1I2ADORA3PTGS2 |
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 |