Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | RNF4 | P78317 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5795287 | 0.92 | SMN1; SMN2 (0.38) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL4757853 | 0.83 | MAPK14 (0.35) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL4707014 | 0.83 | MAPK14 (0.35) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL4707017 | 0.83 | MAPK14 (0.35) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL4757107 | 0.83 | MAPK14 (0.35) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL4707388 | 0.83 | MAPK14 (0.35) | SMN1; SMN2TP53GAAMAPTMAPK14 | |
| SCHEMBL5831107 | 0.83 | PTK2 (0.42) | MAPTMTNR1AMTNR1B | |
| SCHEMBL6205797 | 0.76 | GAA (0.45) | SMN1; SMN2TP53GAAMAPTRNF4 | |
| SCHEMBL6207773 | 0.75 | EPHX2 (0.37) | MAPTALDH1A1LMNAKMT2A | |
| SCHEMBL6207367 | 0.71 | LMNA (0.47) | SMN1; SMN2TP53GAAMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1560832-A1 | PYRIMIDO 4,5-D PYRIMIDINE DERIVATIVES WITH ANTICANCER ACTIVITY | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-10 | — | — | EP | disclosed |
| WO-2004041822-A1 | PYRIMIDO[4,5-D]PYRIMIDINE DERIVATIVES WITH ANTICANCER ACTIVITY | F. HOFFMANN-LA ROCHE AG (CH) | 2004-05-21 | — | — | WO | disclosed |