Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.31 |
| ▸ | PGK1 | P00558 | 1/20 | 0.31 |
| ▸ | PGK2 | P07205 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL20909907 | 0.80 | CCR1 (0.39) | ADRB1PGK1PGK2ACHE | |
| SCHEMBL15832228 | 0.79 | HTR3E (0.35) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL23967200 | 0.79 | IRAK4 (0.32) | ADRB1PGK1PGK2ACHE | |
| SCHEMBL20890078 | 0.77 | ADRB1 (0.40) | ADRB1PGK1PGK2 | |
| SCHEMBL23966994 | 0.76 | HSD11B1 (0.40) | ADRB1PGK1PGK2 | |
| SCHEMBL23967218 | 0.75 | IDH1 (0.37) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL25568031 | 0.75 | PGK1 (0.35) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL12221318 | 0.74 | HTR3E (0.37) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL12153223 | 0.70 | P2RX7 (0.43) | ADRB1PGK1PGK2 | |
| SCHEMBL30565508 | 0.70 | P2RX7 (0.43) | ADRB1PGK1PGK2 |
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-3572413-B1 | 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE AS WEE1 INHIBITOR | SHIJIAZHUANG SAGACITY NEW DRUG DEV CO LTD (CN) | 2021-11-03 | — | — | EP | disclosed |