Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 9/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | PTPRF | P10586 | 1/20 | 0.32 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PTPRB | P23467 | 1/20 | 0.32 |
| ▸ | ACP1 | P24666 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7513751 | 0.89 | LMNA (0.41) | CCR5MEN1KMT2ACYP3A4PTPRF | |
| SCHEMBL7516939 | 0.79 | LMNA (0.43) | MEN1KMT2AFAAH | |
| SCHEMBL7513640 | 0.79 | MAPK14 (0.52) | MEN1KMT2ACYP3A4 | |
| SCHEMBL14104839 | 0.77 | ELANE (0.49) | MEN1KMT2ACYP3A4 | |
| SCHEMBL7532103 | 0.73 | CMA1 (0.45) | MEN1KMT2A | |
| SCHEMBL7513704 | 0.73 | MAPK14 (0.47) | CYP3A4 | |
| SCHEMBL7511268 | 0.72 | SMN1; SMN2 (0.41) | KMT2A | |
| SCHEMBL7516805 | 0.71 | BACE1 (0.47) | MEN1KMT2APTPN1 | |
| SCHEMBL8290131 | 0.71 | SMN1; SMN2 (0.41) | MEN1KMT2ACYP3A4 | |
| SCHEMBL7534170 | 0.70 | BACE1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2153832-A2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2010-02-17 | — | — | EP | disclosed |