Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TAS2R31 | P59538 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.33 |
| ▸ | TUBB | P07437 | 2/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8577398 | 0.92 | GAA (0.38) | GAAKDM4EBACE1MAPTSCN9A | |
| SCHEMBL8577388 | 0.88 | GAA (0.39) | GAAKDM4ETAS2R31BACE1MAPT | |
| SCHEMBL8575371 | 0.82 | HTR6 (0.42) | KDM4EBACE1MAPTABCG2CYP2C19 | |
| SCHEMBL8572760 | 0.82 | PLK1 (0.37) | BACE1ALDH1A1 | |
| SCHEMBL8577569 | 0.82 | ABCG2 (0.42) | GAAKDM4ETAS2R31BACE1MAPT | |
| SCHEMBL8576216 | 0.80 | GAA (0.38) | GAAKDM4EBACE1MAPTL3MBTL1 | |
| SCHEMBL8577389 | 0.78 | GLRA3 (0.34) | MAPTNPC1RAB9AMEN1KMT2A | |
| SCHEMBL8572826 | 0.78 | CYP19A1 (0.37) | MAPTCYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL8575417 | 0.71 | RIPK1 (0.41) | GAAKDM4ETAS2R31MAPTNPC1 | |
| SCHEMBL8577523 | 0.69 | ABCG2 (0.42) | GAAKDM4ETAS2R31MAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998017662-A1 | PHENYL-SUBSTITUTED BICYCLIC HETEROCYCLYL DERIVATIVES AND THEIR USE | NOVARTIS AG (CH) | 1998-04-30 | — | — | WO | claimed |
| WO-1998017662-A1 | PHENYL-SUBSTITUTED BICYCLIC HETEROCYCLYL DERIVATIVES AND THEIR USE | NOVARTIS AG (CH) | 1998-04-30 | — | — | WO | disclosed |