Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 20/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15473106 | 0.94 | ELANE (0.66) | ELANECYP3A4CYP2C9 | |
| SCHEMBL8016374 | 0.94 | ELANE (0.65) | ELANECYP3A4CYP2C9 | |
| SCHEMBL8011392 | 0.91 | ELANE (0.69) | ELANECYP3A4CYP2C9 | |
| SCHEMBL12859098 | 0.90 | ELANE (0.80) | ELANE | |
| SCHEMBL172069 | 0.89 | ELANE (0.67) | ELANECYP3A4CYP2C9 | |
| SCHEMBL8018640 | 0.89 | ELANE (0.69) | ELANECYP3A4CYP2C9 | |
| SCHEMBL8017841 | 0.89 | ELANE (0.67) | ELANE | |
| SCHEMBL15473128 | 0.89 | ELANE (0.53) | ELANE | |
| SCHEMBL124560 | 0.88 | ELANE (0.65) | ELANECYP3A4CYP2C9 | |
| SCHEMBL124750 | 0.88 | ELANE (0.83) | ELANECYP3A4CYP2C9 |
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-2234985-B1 | 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF | Bayer Pharma AG (DE) | 2012-03-07 | — | — | EP | disclosed |
| WO-2009080199-A1 | 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-07-02 | — | — | WO | disclosed |