Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 6/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.38 |
| ▸ | MIF | P14174 | 2/20 | 0.38 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753212 | 1.00 | MAPK14 (0.41) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL3819361 | 0.88 | MAPK14 (0.44) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL3828571 | 0.86 | RXRA (0.43) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL3828575 | 0.86 | RXRA (0.43) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL5670218 | 0.82 | MIF (0.36) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL5670214 | 0.81 | MIF (0.36) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL5670216 | 0.81 | MIF (0.36) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL9753160 | 0.80 | MAPK14 (0.41) | MAPK14ADORA2AADORA1EGFRRAF1 | |
| SCHEMBL9752948 | 0.80 | MAPK14 (0.40) | MAPK14PDE4AALDH1A1GCGRPTGS2 | |
| SCHEMBL9753157 | 0.80 | MAPK14 (0.41) | MAPK14ADORA2AADORA1EGFRRAF1 |
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 |