Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 4/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 9/20 | 0.31 |
| ▸ | MTOR | P42345 | 8/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL2912722 | 1.00 | GPR119 (0.33) | GPR119ATRMALT1PIK3CDMAP4K4 | |
| Ammonia Solution, Strong SCHEMBL2911566 | 0.88 | ALDH1A1 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL2909841 | 0.88 | ALDH1A1 (0.34) | — | |
| Ammonia Solution, Strong SCHEMBL2911403 | 0.86 | FNTA (0.37) | — | |
| SCHEMBL2904171 | 0.80 | GSK3A (0.38) | PIK3CD | |
| SCHEMBL2911578 | 0.80 | GSK3A (0.38) | PIK3CD | |
| SCHEMBL2906860 | 0.78 | GSK3A (0.39) | PIK3CD | |
| SCHEMBL2909976 | 0.77 | GSK3A (0.39) | — | |
| SCHEMBL2904415 | 0.76 | CDK1 (0.36) | PIK3CD | |
| SCHEMBL2913331 | 0.73 | CDK1 (0.41) | — |
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-1537099-B1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2010-08-11 | — | — | EP | disclosed |