Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | AVPR1A | P37288 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 4/20 | 0.39 |
| ▸ | GPR6 | P46095 | 2/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7368183 | 0.78 | AVPR1A (0.54) | AVPR1A | |
| SCHEMBL30454811 | 0.77 | MAPK1 (0.53) | AVPR1A | |
| SCHEMBL12405333 | 0.72 | MEN1 (0.38) | AVPR1A | |
| SCHEMBL11587275 | 0.69 | NPSR1 (0.49) | GAA | |
| SCHEMBL12723718 | 0.68 | AVPR1A (0.41) | AVPR1AGAAPDE2ATP53 | |
| SCHEMBL20571416 | 0.68 | JAK2 (0.40) | AVPR1A | |
| SCHEMBL3920302 | 0.68 | PARP1 (0.38) | CYP11B2KCNH2 | |
| SCHEMBL26547297 | 0.68 | EPHX2 (0.39) | AVPR1AGAA | |
| SCHEMBL19644152 | 0.67 | MAPK1 (0.61) | TP53 | |
| SCHEMBL7017304 | 0.66 | MEN1 (0.50) | — |
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-3630770-B1 | PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS | RELAY THERAPEUTICS INC (US) | 2024-08-28 | — | — | EP | disclosed |