Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 19/20 | 0.78 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.78 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.67 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL333331 | 0.92 | ELANE (0.79) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL5202163 | 0.90 | ELANE (0.66) | ELANECYP3A4CYP2C9 | |
| SCHEMBL5205452 | 0.89 | ELANE (0.75) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL8344144 | 0.89 | ELANE (0.75) | ELANECYP3A4CYP2C9 | |
| SCHEMBL5202886 | 0.88 | ELANE (1.00) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL10090359 | 0.86 | ELANE (0.71) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL10090407 | 0.85 | ELANE (0.70) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL5623594 | 0.85 | ELANE (0.69) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 | |
| SCHEMBL5204844 | 0.85 | ELANE (0.71) | ELANECYP3A4CYP2C9ADRB1HTR1A | |
| SCHEMBL8284518 | 0.85 | ELANE (0.71) | ELANECYP3A4CYP2C9CYP2C8CYP2C19 |
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-1554246-B1 | DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2007-08-22 | — | — | EP | disclosed |
| US-7230017-B2 | Dihydropyridinone derivatives | BAYER HEALTHCARE AG (DE) | 2007-06-12 | — | — | US | disclosed |
| US-7230017-B2 | Dihydropyridinone derivatives | BAYER HEALTHCARE AG (DE) | 2007-06-12 | — | — | US | disclosed |
| WO-2004020410-A2 | DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2004-03-11 | — | — | WO | disclosed |