Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 11/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | FASN | P49327 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13081547 | 1.00 | ELANE (0.33) | ELANECYP2C9P2RX7CYP3A4HTR7 | |
| SCHEMBL7552777 | 0.91 | HSD11B1 (0.32) | ELANE | |
| SCHEMBL13054185 | 0.91 | HSD11B1 (0.32) | ELANE | |
| SCHEMBL8210521 | 0.85 | BACE1 (0.35) | ELANECYP2C9CYP3A4 | |
| SCHEMBL7547187 | 0.85 | BACE1 (0.35) | ELANECYP2C9CYP3A4 | |
| SCHEMBL13081258 | 0.84 | TDP1 (0.31) | — | |
| SCHEMBL8412215 | 0.82 | PGR (0.33) | — | |
| SCHEMBL7560896 | 0.82 | ELANE (0.31) | ELANE | |
| SCHEMBL13053899 | 0.82 | ELANE (0.31) | ELANE | |
| SCHEMBL7546301 | 0.82 | HTR7 (0.31) | HTR7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8183252-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |