Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 6/20 | 0.40 |
| ▸ | NCOA2 | Q15596 | 6/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 6/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DUT | P33316 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | ALPG | P10696 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23663106 | 0.72 | TSHR (0.35) | ALDH1A1MAPTHPGDDUTGAA | |
| SCHEMBL19655936 | 0.70 | DUT (0.33) | DUT | |
| SCHEMBL6320498 | 0.68 | ALDH1A1 (0.56) | ALDH1A1MAPTPPARGNCOA2NCOA1 | |
| SCHEMBL5791378 | 0.68 | ALDH1A1 (1.00) | ALDH1A1MAPTPPARGNCOA2NCOA1 | |
| SCHEMBL5793071 | 0.68 | MAPT (0.56) | ALDH1A1MAPTPPARGNCOA2NCOA1 | |
| SCHEMBL5795084 | 0.68 | ALDH1A1 (0.63) | ALDH1A1MAPTPPARGNCOA2NCOA1 | |
| SCHEMBL25386149 | 0.65 | DUT (0.35) | DUT | |
| SCHEMBL5736393 | 0.64 | DUT (0.34) | DUT | |
| SCHEMBL23610120 | 0.63 | DUT (0.44) | DUT | |
| SCHEMBL9025309 | 0.63 | HCAR2 (0.41) | — |
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-2017204316-A1 | 5-OXO-1,2,4-TRIAZINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION THEREOF | 塩野義製薬株式会社 | 2017-11-30 | — | — | WO | disclosed |