Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA2 | P47869 | 4/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.35 |
| ▸ | PDE8B | O95263 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4707683 | 0.83 | HSP90AA1 (0.35) | GABRA2GABRB2HSP90AA1HSP90AB1 | |
| SCHEMBL3667322 | 0.81 | ROCK2 (0.43) | JAK2GRM2 | |
| SCHEMBL4708592 | 0.80 | HSP90AA1 (0.33) | GABRA2GABRB2HSP90AA1HSP90AB1PTGER4 | |
| SCHEMBL4638838 | 0.77 | POLB (0.38) | HSP90AA1HSP90AB1GRM2PTGER4 | |
| SCHEMBL4804309 | 0.77 | PAX8 (0.35) | GABRA2GABRB2JAK2JAK1JAK3 | |
| SCHEMBL4706975 | 0.77 | HSP90AA1 (0.35) | GABRA2GABRB2HSP90AA1HSP90AB1GRM2 | |
| SCHEMBL4705960 | 0.77 | HSP90AA1 (0.33) | GABRA2GABRB2HSP90AA1HSP90AB1 | |
| SCHEMBL4297826 | 0.76 | CDC7 (0.44) | JAK2 | |
| SCHEMBL4708507 | 0.74 | HSP90AA1 (0.34) | HSP90AA1HSP90AB1GRM2 | |
| SCHEMBL4707593 | 0.74 | P2RX7 (0.36) | GABRA2GABRB2HSP90AA1HSP90AB1 |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |