Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 7/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL467693 | 0.92 | GRIN2B (0.49) | PNMTADRA2AADRA2BADRA2CGRIN2B | |
| SCHEMBL14876134 | 0.88 | PNMT (0.49) | PNMTADRA2AADRA2BADRA2CGAA | |
| SCHEMBL4136971 | 0.86 | USP30 (0.47) | — | |
| Hydrochloric Acid SCHEMBL7516853 | 0.84 | NPC1 (0.46) | PNMTADRA2AADRA2BADRA2CGAA | |
| Hydrochloric Acid SCHEMBL7508533 | 0.83 | ALDH1A1 (0.48) | PNMTADRA2AADRA2BADRA2CGAA | |
| Hydrochloric Acid SCHEMBL7507958 | 0.82 | NPC1 (0.45) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL2061518 | 0.81 | MEN1 (0.48) | PNMTADRA2AGRIN2B | |
| SCHEMBL4764965 | 0.80 | HRH3 (0.50) | PNMTADRA2AGRIN2BCYP2D6 | |
| SCHEMBL1950958 | 0.80 | MEN1 (0.49) | PNMTADRA2AADRA2BADRA2CGRIN2B | |
| SCHEMBL2060974 | 0.80 | ALDH1A1 (0.47) | PNMTADRA2AGRIN2BGAA |
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-2022171128-A1 | PYRAZOLO[3,4-D]PYRIMIDINE-3-KETONE DERIVATIVE SERVING AS WEE-1 INHIBITOR | 微境生物医药科技(上海)有限公司 | 2022-08-18 | — | — | WO | disclosed |