Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 2/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PTPRC | P08575 | 2/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28859554 | 0.85 | CTSK (0.53) | CTSSCTSKMAPT | |
| SCHEMBL8285876 | 0.83 | ALDH1A1 (0.54) | ALDH1A1HTR1DKMT2A | |
| SCHEMBL5402611 | 0.82 | CA12 (0.46) | ALDH1A1CTSKOPRK1MAPTAKT1 | |
| SCHEMBL14543853 | 0.82 | ALDH1A1 (0.57) | ALDH1A1RIPK1HTR1DKMT2A | |
| SCHEMBL9575011 | 0.80 | CYP26A1 (0.43) | CTSSCTSKRIPK1L3MBTL1AKT1 | |
| SCHEMBL14519846 | 0.79 | TSHR (0.56) | ALDH1A1HTR1DMAPTKMT2A | |
| SCHEMBL2294452 | 0.79 | HDAC1 (0.38) | ALDH1A1CTSSCTSKRIPK1L3MBTL1 | |
| SCHEMBL5700891 | 0.79 | ABCB1 (0.41) | ALDH1A1MAPTKMT2A | |
| SCHEMBL15983852 | 0.79 | CTSK (0.50) | CTSSCTSKOPRK1MAPT | |
| SCHEMBL16379594 | 0.79 | CTSK (0.50) | CTSSCTSKOPRK1MAPT |
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-2170848-B1 | PYRAZINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF LUNG DISEASES | ASTRAZENECA AB (SE) | 2014-10-22 | — | — | EP | disclosed |