Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | CDK9 | P50750 | 2/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8300200 | 0.81 | KDM4E (0.37) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8613755 | 0.76 | ITGB3 (0.56) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8301327 | 0.76 | KDM4E (0.43) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8298757 | 0.76 | HRH3 (0.49) | ITGB3ITGA2BFFAR4 | |
| SCHEMBL8300331 | 0.73 | KDM4E (0.43) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8305336 | 0.73 | KDM4E (0.43) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8298652 | 0.73 | ITGB3 (0.45) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL16499811 | 0.71 | HTR2A (0.44) | ITGB3ITGA2BKDM4EALDH1A1HTR2A | |
| SCHEMBL8300686 | 0.70 | NAMPT (0.43) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8300030 | 0.70 | KDM4E (0.45) | ITGB3ITGA2BKDM4EMEN1ALDH1A1 |
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 1 patent. 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 |