Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 5/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753675 | 0.91 | MAPK14 (0.41) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL9753678 | 0.91 | MAPK14 (0.41) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL9752969 | 0.83 | MAPK14 (0.47) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL9753321 | 0.80 | MAPK14 (0.44) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL9753402 | 0.80 | MAPK14 (0.46) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL27348767 | 0.79 | DHODH (0.47) | MAPK14EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL9752906 | 0.78 | HMGCR (0.37) | ADORA3PTGS2ALDH1A1KCNH2HDAC1 | |
| SCHEMBL9753005 | 0.78 | HMGCR (0.51) | ADORA3PTGS2ALDH1A1 | |
| SCHEMBL9752908 | 0.78 | HMGCR (0.37) | ADORA3PTGS2ALDH1A1KCNH2HDAC1 | |
| SCHEMBL9753398 | 0.77 | MAPK14 (0.43) | MAPK14EGFRRAF1ADORA3ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991018903-A1 | PYRROLOPYRIDAZINE COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-12-12 | — | — | WO | disclosed |
| CN-1056690-A | PYRROLOPYRIDAZINE COMPOUNDS | FUJISAWA PHARMACEUTICAL CO (JP) | 1991-12-04 | — | — | CN | disclosed |