Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
| ▸ | TRPC6 | Q9Y210 | 1/20 | 0.37 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17828175 | 0.86 | ALDH1A1 (0.48) | KCNH2SCN5ASCN9AHRH3DRD2 | |
| SCHEMBL12426 | 0.86 | KCNH2 (0.46) | KCNH2SCN5ASCN9AJAK2JAK1 | |
| SCHEMBL16132004 | 0.82 | HRH3 (0.49) | KCNH2SCN5ASCN9AHRH3PDE10A | |
| SCHEMBL12894384 | 0.82 | HRH3 (0.53) | KCNH2SCN5ASCN9AHRH3LTA4H | |
| SCHEMBL12064 | 0.80 | HRH3 (0.55) | KCNH2SCN5ASCN9AHRH3LTA4H | |
| SCHEMBL17409812 | 0.80 | TRPC6 (0.43) | KCNH2SCN5ASCN9AHRH3TRPC6 | |
| SCHEMBL26031622 | 0.80 | TRPC6 (0.43) | KCNH2SCN5ASCN9AHRH3TRPC6 | |
| SCHEMBL7617880 | 0.79 | ALDH1A1 (0.56) | KCNH2SCN5ASCN9AHRH3TSHR | |
| SCHEMBL12513 | 0.79 | LTA4H (0.45) | KCNH2SCN5ASCN9AHRH3DRD4 | |
| SCHEMBL20160684 | 0.78 | CXCR4 (0.49) | KCNH2SCN5ASCN9AHRH3KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |