Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235894 | 0.90 | GSK3B (0.57) | CASP1ROCK2ROCK1GSK3BP2RX7 | |
| SCHEMBL5234548 | 0.87 | MAPT (0.49) | CASP1ROCK2ROCK1GSK3BCYP2C9 | |
| SCHEMBL5243973 | 0.83 | TSHR (0.48) | CASP1ROCK2ROCK1GSK3BTSHR | |
| SCHEMBL4856266 | 0.82 | CASP1 (0.69) | CASP1ROCK2ROCK1GSK3BTAAR1 | |
| SCHEMBL5229171 | 0.78 | GSK3B (0.42) | CASP1ROCK2GSK3BMAPK1ALDH1A1 | |
| SCHEMBL5232027 | 0.78 | EPHX1 (0.51) | ROCK2ROCK1GSK3BTSHRMAPK1 | |
| SCHEMBL5229174 | 0.77 | GSK3B (0.43) | ROCK2GSK3BP2RX7MAPK1 | |
| SCHEMBL5229836 | 0.76 | GSK3B (0.52) | GSK3B | |
| SCHEMBL4851138 | 0.76 | GSK3B (0.58) | CASP1ROCK2ROCK1GSK3BTAAR1 | |
| SCHEMBL5227844 | 0.74 | GSK3B (0.57) | GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611121-B1 | PYRIDAZINONE DERIVATIVES AS CDK2-INHIBITORS | AVENTIS PHARMA SA (FR) | 2007-08-08 | — | — | EP | claimed |
| EP-1581505-B1 | PYRIDAZINONE DERIVATIVES AS GSK-3BETA INHIBITORS | SANOFI AVENTIS DEUTSCHLAND (DE) | 2007-08-01 | — | — | EP | claimed |