Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 4/20 | 0.32 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13177203 | 0.91 | ALDH1A1 (0.40) | ALDH1A1HSD17B10CYP3A4HPGD | |
| SCHEMBL21236751 | 0.89 | SIGMAR1 (0.38) | ALDH1A1CYP3A4TSHRSIGMAR1L3MBTL1 | |
| SCHEMBL13821963 | 0.88 | SIGMAR1 (0.35) | ALDH1A1CYP3A4SIGMAR1L3MBTL1TDP1 | |
| SCHEMBL12557773 | 0.87 | L3MBTL1 (0.40) | ALDH1A1HPGDATMSIGMAR1L3MBTL1 | |
| SCHEMBL18872362 | 0.85 | SIGMAR1 (0.34) | SIGMAR1 | |
| SCHEMBL10029773 | 0.85 | SIGMAR1 (0.34) | SIGMAR1 | |
| SCHEMBL18900780 | 0.84 | SIGMAR1 (0.34) | ALDH1A1SIGMAR1SLC6A2 | |
| SCHEMBL16775507 | 0.84 | SIGMAR1 (0.35) | SIGMAR1 | |
| SCHEMBL12700576 | 0.83 | ALDH1A1 (0.39) | ALDH1A1HSD17B10CYP3A4HPGDALOX15 | |
| SCHEMBL13190815 | 0.82 | SIGMAR1 (0.33) | SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0891121-B1 | ORGANIC ELECTROLUMINESCENT ELEMENTS | TDK CORP (JP) | 2012-09-26 | — | — | EP | disclosed |