Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | GSK3A | P49840 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3284186 | 0.84 | STK17A (0.58) | MAPTPOLBMAPK1STK17AAURKA | |
| SCHEMBL3284190 | 0.82 | MAPT (0.52) | MAPTPOLBMAPK1STK17AAURKA | |
| SCHEMBL1916987 | 0.76 | STK17A (0.52) | MAPTPOLBMAPK1STK17AAURKA | |
| SCHEMBL1916871 | 0.72 | GSK3B (0.58) | MAPTSTK17AAURKAGSK3AGSK3B | |
| SCHEMBL1916586 | 0.69 | STK17A (0.61) | STK17AAURKAGSK3AGSK3B | |
| SCHEMBL1917178 | 0.69 | STK17A (0.63) | MAPTSTK17AAURKAGSK3AGSK3B | |
| SCHEMBL15227963 | 0.68 | MRGPRX4 (0.66) | MAPTMAPK1MEN1KMT2ANPC1 | |
| SCHEMBL31237014 | 0.68 | MAPT (0.57) | MAPTPOLBMAPK1MEN1KMT2A | |
| SCHEMBL31237109 | 0.67 | MAPT (0.53) | MAPTPOLBMAPK1MEN1KMT2A | |
| Phenyl Propionic Acid SCHEMBL3290703 | 0.67 | GSK3B (0.54) | MAPTMAPK1STK17AAURKAGSK3A |
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-2332924-A1 | Pyrimidine derivates, medicaments comprising them, their use and process of their preparation | Boehringer Ingelheim Pharma GmbH & Co. KG (DE) | 2011-06-15 | — | — | EP | disclosed |