Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 20/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL230975 | 1.00 | ELANE (0.67) | ELANECYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL231082 | 0.99 | ELANE (0.66) | ELANECYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2742318 | 0.89 | ELANE (0.65) | ELANECYP2C19 | |
| SCHEMBL2742319 | 0.89 | ELANE (0.65) | ELANECYP2C19 | |
| SCHEMBL15354362 | 0.87 | ELANE (0.50) | ELANECYP2C19 | |
| SCHEMBL15354374 | 0.87 | ELANE (0.50) | ELANECYP2C19 | |
| SCHEMBL14632124 | 0.87 | ELANE (0.63) | ELANECYP2C19 | |
| SCHEMBL230879 | 0.86 | ELANE (0.64) | ELANECYP3A4CYP2C9CYP2C19 | |
| SCHEMBL230772 | 0.86 | ELANE (0.64) | ELANECYP3A4CYP2C9CYP2C19 | |
| SCHEMBL231888 | 0.86 | ELANE (0.62) | ELANECYP3A4CYP2C9CYP2C19 |
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-2385945-B1 | TRIAZOLO AND TETRAZOLO PYRIMIDINE DERIVATIVES AS HNE INHIBITORS FOR TREATING COPD | BAYER IP GMBH (DE) | 2013-01-23 | — | — | EP | disclosed |
| WO-2010078953-A1 | TRIAZOLO AND TETRAZOLO PYRIMIDINE DERIVATIVES AS HNE INHIBITORS FOR TREATING COPD | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-07-15 | — | — | WO | disclosed |