Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13489651 | 0.85 | SYK (0.48) | SYKPPARAACEPSEN1PSEN2 | |
| SCHEMBL31391011 | 0.84 | SYK (0.48) | SYKCTSSCTSLATMBACE1 | |
| SCHEMBL1568742 | 0.81 | CCR6 (0.41) | SYKMAPTABCB1BACE1 | |
| SCHEMBL4891550 | 0.80 | SYK (0.50) | SYKCTSSCTSLATMBACE1 | |
| SCHEMBL3221814 | 0.80 | SYK (0.46) | SYKPPARAACEPSEN1PSEN2 | |
| SCHEMBL3221836 | 0.80 | SYK (0.46) | SYKPPARAACEPSEN1PSEN2 | |
| SCHEMBL1554884 | 0.78 | SYK (0.48) | SYKCTSSMAPTCTSLATM | |
| SCHEMBL4896495 | 0.78 | SYK (0.48) | SYKCTSSMAPTCTSLATM | |
| SCHEMBL15316174 | 0.78 | SYK (0.51) | SYKCTSSCTSLBACE1 | |
| SCHEMBL15003939 | 0.78 | SYK (0.51) | SYKCTSSCTSLBACE1 |
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-2321285-A1 | DIAZEPAN AND PIPERAZINE DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | F. Hoffmann-La Roche AG (CH) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010012619-A1 | DIAZEPAN AND PIPERAZINE DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-04 | — | — | WO | disclosed |