Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 3/20 | 0.40 |
| ▸ | ABL1 | P00519 | 5/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 4/20 | 0.36 |
| ▸ | WNT1 | P04628 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9895436 | 0.93 | GABRA5 (0.42) | GABRA5ABL1EGLN1HDAC1KCNH2 | |
| SCHEMBL9895679 | 0.85 | GABRA5 (0.37) | GABRA5ABL1EGLN1CYP1A2 | |
| SCHEMBL9947565 | 0.83 | GABRA5 (0.42) | GABRA5EGLN1GAA | |
| SCHEMBL9895619 | 0.82 | GABRA5 (0.47) | GABRA5ABL1CYP1A2 | |
| SCHEMBL9947559 | 0.81 | MAP4K4 (0.39) | DYRK1A | |
| SCHEMBL9894886 | 0.76 | GABRA5 (0.51) | GABRA5ABL1CYP1A2CYP2C19 | |
| SCHEMBL9895606 | 0.76 | EGLN1 (0.40) | GABRA5EGLN1HDAC1GABRA1 | |
| SCHEMBL9895449 | 0.76 | GABRA5 (0.53) | GABRA5EGLN1 | |
| SCHEMBL9894488 | 0.75 | GABRA5 (0.43) | GABRA5EGLN1CYP1A2CYP2C19 | |
| SCHEMBL9895824 | 0.75 | GABRA5 (0.39) | GABRA5ABL1HDAC1CYP1A2 |
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-2012076590-A1 | NOVEL TRIAZOLE COMPOUNDS III | F. HOFFMANN-LA ROCHE AG (CH) | 2012-06-14 | — | — | WO | disclosed |