Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.45 |
| ▸ | PRKACA | P17612 | 3/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.45 |
| ▸ | GSK3A | P49840 | 3/20 | 0.45 |
| ▸ | GSK3B | P49841 | 3/20 | 0.45 |
| ▸ | RPS6KA3 | P51812 | 3/20 | 0.45 |
| ▸ | NEK4 | P51957 | 3/20 | 0.45 |
| ▸ | CSNK1G2 | P78368 | 3/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.45 |
| ▸ | PRKG1 | Q13976 | 3/20 | 0.45 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.45 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.45 |
| ▸ | HIPK4 | Q8NE63 | 3/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.45 |
| ▸ | SGK2 | Q9HBY8 | 3/20 | 0.45 |
| ▸ | CSNK1G1 | Q9HCP0 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4389670 | 0.83 | KMT2A (0.55) | PDE10AKCNH3MEN1KMT2A | |
| SCHEMBL1308942 | 0.73 | CA12 (0.56) | PDE10AKCNH3ADRA2CROCK2GRK2 | |
| SCHEMBL3549143 | 0.72 | KCNH3 (0.53) | PDE10AKCNH3ADRA2CROCK2GRK2 | |
| SCHEMBL8121604 | 0.70 | KMT2A (0.55) | KCNH3MEN1KMT2AHTTALDH1A1 | |
| SCHEMBL5999682 | 0.69 | KDR (0.59) | CHEK1CHEK2PRKACARPS6KB1GSK3A | |
| SCHEMBL19241691 | 0.69 | F2 (0.56) | KCNH3ADRA2CMAPKAPK2HTTALDH1A1 | |
| SCHEMBL19242049 | 0.69 | KDM4E (0.61) | KCNH3ADRA2CHTTALDH1A1MAPT | |
| SCHEMBL6000398 | 0.68 | ALDH1A1 (0.49) | CHEK1CHEK2PRKACARPS6KB1GSK3A | |
| SCHEMBL18249767 | 0.68 | HDAC1 (0.57) | KCNH3ADRA2CROCK2GRK2SPHK2 | |
| SCHEMBL2118469 | 0.67 | CYP3A4 (0.41) | MEN1KMT2AL3MBTL1HTTALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808306-B1 | NEW DERIVATIVES OF PYRIDINE OR PYRIDAZINE, PROCESS FOR PRODUCTION THEREOF AND MEDICAMENTS CONTAINING THESE COMPOUNDS | ROCHE DIAGNOSTICS GMBH (DE) | 1999-08-04 | — | — | EP | disclosed |
| US-5786371-A | INHIBIT AGGREGATION OF BLOOD PLATELETS | BOEHRINGER MANNHEIM GMBH (DE) | 1998-07-28 | — | — | US | disclosed |
| EP-0808306-A1 | NEW DERIVATIVES OF PYRIDINE OR PYRIDAZINE, PROCESS FOR PRODUCTION THEREOF AND MEDICAMENTS CONTAINING THESE COMPOUNDS | Roche Diagnostics GmbH (DE) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024586-A1 | NEW DERIVATIVES OF PYRIDINE OR PYRIDAZINE, PROCESS FOR PRODUCTION THEREOF AND MEDICAMENTS CONTAINING THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1996-08-15 | — | — | WO | disclosed |