Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 6/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.52 |
| ▸ | PDE5A | O76074 | 2/20 | 0.52 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.49 |
| ▸ | TCF7L2 | Q9NQB0 | 2/20 | 0.49 |
| ▸ | CCR4 | P51679 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13944184 | 0.91 | PDE2A (0.59) | HTR2CHRH4CTNNB1TCF7L2CCR4 | |
| SCHEMBL13942986 | 0.90 | CTNNB1 (0.48) | HTR2CCTNNB1TCF7L2CCR4PIK3CA | |
| SCHEMBL3644693 | 0.89 | HTR2C (0.58) | HTR2CHRH4PDE5AHTTHTR3A | |
| SCHEMBL13946820 | 0.84 | HTR2C (0.70) | HTR2CHRH4PDE5AHTTHTR3A | |
| SCHEMBL13944177 | 0.83 | HTR2C (0.57) | HTR2CHRH4CTNNB1TCF7L2 | |
| SCHEMBL13947204 | 0.82 | HTR2C (0.58) | HTR2CCCR4PIK3CA | |
| SCHEMBL13947370 | 0.81 | ACHE (0.53) | HRH4PDE5ACTNNB1TCF7L2CCR4 | |
| SCHEMBL13946815 | 0.81 | HTR2C (0.72) | HTR2CHRH4PDE5AHTTHTR3A | |
| SCHEMBL13943298 | 0.81 | HTR2C (0.61) | HTR2CHRH4PDE5AHTTHTR3A | |
| SCHEMBL13946788 | 0.81 | PIK3CA (0.61) | HTR2CCCR4PIK3CA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009023978-A1 | PYRAZOLO [3,4 -D] PYRIMIDINE COMPOUNDS AND THEIR USE AS MODULATORS OF PROTEIN KINASE | ONCALIS AG (CH) | 2009-02-26 | — | — | WO | disclosed |
| EP-2025678-A1 | Pyrazolo[3,4-d]pyrimidine compounds and their use as modulators of protein kinase | Oncalis AG (CH) | 2009-02-18 | — | — | EP | disclosed |