Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.54 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13583137 | 0.84 | APP (0.43) | APPFDPSHPGDALDH1A1THRB | |
| SCHEMBL13583139 | 0.84 | APP (0.43) | APPFDPSHPGDALDH1A1THRB | |
| SCHEMBL13581945 | 0.82 | CA2 (0.45) | APPESR1HPGDALDH1A1THRB | |
| SCHEMBL13581948 | 0.82 | CA2 (0.45) | APPESR1HPGDALDH1A1THRB | |
| SCHEMBL14262624 | 0.80 | FDPS (0.64) | APPFDPSHPGDALDH1A1THRB | |
| SCHEMBL16607414 | 0.79 | APP (0.56) | APPFDPSHPGDALDH1A1THRB | |
| SCHEMBL2236512 | 0.78 | APP (0.50) | APPFDPSMETHPGDALDH1A1 | |
| SCHEMBL2235002 | 0.77 | APP (0.78) | APPESR1METHPGDALDH1A1 | |
| SCHEMBL2236531 | 0.77 | ALOX5 (0.43) | — | |
| SCHEMBL6058723 | 0.77 | APP (0.69) | APPFDPSESR1METLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011093524-A1 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2011-08-04 | — | — | WO | disclosed |