Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | BRAF | P15056 | 5/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL1751196 | 0.89 | NR1H2 (0.43) | KDM4EALDH1A1BRAFFLT3ROCK2 | |
| SCHEMBL5562265 | 0.81 | SQOR (0.36) | ALDH1A1ROCK2ROCK1CYP3A4MEN1 | |
| SCHEMBL5561371 | 0.79 | ROCK1 (0.33) | ALDH1A1ROCK2ROCK1CYP3A4MEN1 | |
| SCHEMBL5562545 | 0.79 | MAPT (0.36) | KDM4EALDH1A1 | |
| SCHEMBL5567645 | 0.77 | SQOR (0.32) | CYP3A4CYP2D6 | |
| SCHEMBL5567642 | 0.77 | SQOR (0.32) | CYP3A4CYP2D6 | |
| SCHEMBL5567692 | 0.76 | PARP1 (0.36) | MEN1KMT2A | |
| SCHEMBL5562320 | 0.75 | CYP1A2 (0.37) | ROCK1CYP3A4 | |
| SCHEMBL5562322 | 0.71 | MKNK1 (0.32) | CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1750157 | 0.70 | NR1H2 (0.42) | — |
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-1751141-A1 | NOVEL PYRIDAZINONE DERIVATIVES AS INHIBITORS OF CDK2 | Aventis Pharma S.A. (FR) | 2007-02-14 | — | — | EP | disclosed |
| WO-2005111019-A1 | NOVEL PYRIDAZINONE DERIVATIVES AS INHIBITORS OF CDK2 | AVENTIS PHARMA S.A. (FR) | 2005-11-24 | — | — | WO | disclosed |