Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.30 |
| ▸ | CTSA | P10619 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | TBXAS1 | P24557 | 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 | |
|---|---|---|---|---|
| SCHEMBL2232578 | 0.82 | PDPK1 (0.34) | THRATHRBFFAR1ESR1DEGS1 | |
| SCHEMBL2298330 | 0.80 | MAPK14 (0.34) | — | |
| SCHEMBL2231441 | 0.80 | PDE10A (0.37) | — | |
| SCHEMBL2232843 | 0.79 | ESR1 (0.41) | MAPTPPARAFFAR1ESR1KDM4E | |
| SCHEMBL13582353 | 0.77 | TBXAS1 (0.35) | MAPTTHRATHRBESR1KDM4E | |
| SCHEMBL13582351 | 0.77 | TBXAS1 (0.35) | MAPTTHRATHRBESR1KDM4E | |
| SCHEMBL13582348 | 0.77 | TBXAS1 (0.35) | MAPTTHRATHRBESR1KDM4E | |
| SCHEMBL13582500 | 0.76 | ESR1 (0.43) | PPARAESR1ESR2KDM4EDEGS1 | |
| SCHEMBL13582495 | 0.76 | ESR1 (0.43) | PPARAESR1ESR2KDM4EDEGS1 | |
| SCHEMBL2232838 | 0.72 | CA12 (0.54) | ESR1 |
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 |