Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 20/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL593052 | 0.92 | ELANE (0.84) | ELANECYP2C9CYP3A4 | |
| SCHEMBL123593 | 0.91 | ELANE (0.83) | ELANECYP2C9CYP3A4 | |
| SCHEMBL18839888 | 0.91 | ELANE (0.83) | ELANECYP2C9CYP3A4 | |
| SCHEMBL7889157 | 0.90 | ELANE (0.84) | ELANECYP2C9CYP3A4 | |
| SCHEMBL2116611 | 0.90 | ELANE (0.84) | ELANECYP2C9CYP3A4 | |
| SCHEMBL587332 | 0.90 | ELANE (0.84) | ELANECYP2C9CYP3A4 | |
| SCHEMBL3717555 | 0.89 | ELANE (0.74) | ELANECYP2C9CYP3A4 | |
| SCHEMBL121093 | 0.89 | ELANE (0.74) | ELANECYP2C9CYP3A4 | |
| SCHEMBL3718558 | 0.85 | ELANE (0.79) | ELANECYP2C9CYP3A4 | |
| SCHEMBL123646 | 0.85 | ELANE (0.79) | ELANECYP2C9CYP3A4 |
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-A1 | 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF | Bayer Schering Pharma Aktiengesellschaft (DE) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009080199-A1 | 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-07-02 | — | — | WO | disclosed |