Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14401024 | 0.82 | MMP8 (0.50) | MMP8ALDH1A1TP53NPY1RNPY2R | |
| SCHEMBL18857043 | 0.78 | CTRB1 (0.51) | ALDH1A1TACR1CTSK | |
| SCHEMBL5643877 | 0.78 | DHODH (0.39) | MAPK1NPSR1GAAMAPTL3MBTL1 | |
| SCHEMBL809450 | 0.76 | MMP8 (0.51) | MMP8ALDH1A1TP53NPY1RNPY2R | |
| SCHEMBL30713077 | 0.74 | AURKA (0.48) | MMP8ALDH1A1GAAMAPTDHODH | |
| SCHEMBL28511516 | 0.74 | AURKA (0.48) | MMP8ALDH1A1GAAMAPTDHODH | |
| SCHEMBL28071277 | 0.73 | CA12 (0.52) | ALDH1A1GAAMAPTCA12CA1 | |
| SCHEMBL28814504 | 0.73 | AURKA (0.45) | MMP8ALDH1A1GAAMAPTDHODH | |
| SCHEMBL6101799 | 0.73 | MMP8 (0.46) | MMP8ALDH1A1TP53NPY1RNPY2R | |
| SCHEMBL28507024 | 0.73 | SMN1; SMN2 (0.51) | MMP8ALDH1A1TP53GAAMAPT |
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-2006007586-A1 | ORGANOCATALYSTS AND METHODS OF USE IN CHEMICAL SYNTHESIS | SCIENCE & TECHNOLOGY CORPORATION @ UNM (US) | 2006-01-19 | — | — | WO | disclosed |