Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 20/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL3482490 | 0.88 | ELANE (0.69) | ELANECYP3A4CYP2C9 | |
| SCHEMBL13254814 | 0.86 | ELANE (0.78) | ELANECYP3A4CYP2C9 | |
| SCHEMBL123593 | 0.84 | ELANE (0.83) | ELANECYP3A4CYP2C9 | |
| SCHEMBL18839888 | 0.84 | ELANE (0.83) | ELANECYP3A4CYP2C9 | |
| SCHEMBL29443698 | 0.84 | ELANE (1.00) | ELANECYP3A4CYP2C9 | |
| SCHEMBL125403 | 0.84 | ELANE (0.83) | ELANECYP3A4CYP2C9 | |
| SCHEMBL121431 | 0.84 | ELANE (1.00) | ELANECYP3A4CYP2C9 | |
| SCHEMBL3663656 | 0.84 | ELANE (1.00) | ELANECYP3A4CYP2C9 | |
| SCHEMBL29636980 | 0.84 | ELANE (1.00) | ELANECYP3A4CYP2C9 | |
| SCHEMBL29709949 | 0.84 | ELANE (1.00) | 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 |
|---|---|---|---|---|---|---|---|
| US-8288402-B2 | 4-(4-cyano-2-thioaryl)dihydropyrimidinones and their use | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2012-10-16 | — | — | US | disclosed |
| EP-2234985-B1 | 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF | Bayer Pharma AG (DE) | 2012-03-07 | — | — | EP | disclosed |