Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3162425 | 0.91 | EGFR (0.53) | ALDH1A1SMN1; SMN2MAPTLMNAGAA | |
| SCHEMBL3166249 | 0.89 | GAA (0.54) | ALDH1A1SMN1; SMN2MAPTPOLBGAA | |
| SCHEMBL3170421 | 0.89 | SMN1; SMN2 (0.55) | ALDH1A1SMN1; SMN2GAAKDM4EEGFR | |
| SCHEMBL3162806 | 0.88 | JAK3 (0.51) | ALDH1A1SMN1; SMN2MAPTLMNAGAA | |
| SCHEMBL3161698 | 0.88 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNAGAAEGFR | |
| SCHEMBL3175543 | 0.88 | EGFR (0.50) | ALDH1A1SMN1; SMN2MAPTLMNAGAA | |
| SCHEMBL3165286 | 0.87 | USP2 (0.57) | ALDH1A1SMN1; SMN2MAPTLMNAPOLB | |
| SCHEMBL3258722 | 0.86 | EGFR (0.46) | ALDH1A1SMN1; SMN2MAPTLMNAGAA | |
| SCHEMBL3164831 | 0.84 | MAPT (0.50) | ALDH1A1SMN1; SMN2MAPTLMNAGAA | |
| SCHEMBL3160939 | 0.84 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2LMNAPOLBKDM4E |
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-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |