Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | HTR2C | P28335 | 11/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | BCDIN3D | Q7Z5W3 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13943321 | 0.88 | TP53 (0.65) | TP53HTR2CPDE2APIK3CABCDIN3D | |
| SCHEMBL13943327 | 0.84 | TP53 (0.60) | TP53HTR2CPDE2APIK3CA | |
| SCHEMBL13946789 | 0.83 | TP53 (0.59) | TP53HTR2CPDE2APIK3CA | |
| SCHEMBL13944177 | 0.83 | HTR2C (0.57) | TP53HTR2C | |
| SCHEMBL13943310 | 0.81 | HTR2C (0.65) | TP53HTR2CPDE2ABCDIN3D | |
| SCHEMBL13944754 | 0.80 | HTR2C (0.53) | HTR2CACHEPIK3CABCDIN3D | |
| SCHEMBL13947204 | 0.77 | HTR2C (0.58) | TP53HTR2CPIK3CA | |
| SCHEMBL13947370 | 0.77 | ACHE (0.53) | ACHE | |
| SCHEMBL13943748 | 0.77 | TP53 (0.61) | TP53HTR2CPDE2ABCDIN3D | |
| SCHEMBL13942986 | 0.77 | CTNNB1 (0.48) | HTR2CPDE2APIK3CABCDIN3D |
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-2009023978-A1 | PYRAZOLO [3,4 -D] PYRIMIDINE COMPOUNDS AND THEIR USE AS MODULATORS OF PROTEIN KINASE | ONCALIS AG (CH) | 2009-02-26 | — | — | WO | disclosed |