Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | BTN3A1 | O00481 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.37 |
| ▸ | SQLE | Q14534 | 5/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL9579493 | 1.00 | TRPA1 (0.40) | TRPA1BTN3A1KMT2AMEN1CYP3A4 | |
| SCHEMBL1305942 | 0.80 | — | — | |
| SCHEMBL1300875 | 0.78 | SQLE (0.60) | KMT2AMEN1CYP3A4ALOX15MAPT | |
| SCHEMBL1300878 | 0.78 | SQLE (0.60) | KMT2AMEN1CYP3A4ALOX15MAPT | |
| SCHEMBL1829279 | 0.78 | SQLE (0.60) | KMT2AMEN1CYP3A4ALOX15MAPT | |
| SCHEMBL1304411 | 0.77 | KMT2A (0.36) | KMT2AMEN1CYP3A4ALOX15MAPT | |
| SCHEMBL379620 | 0.77 | KMT2A (0.36) | KMT2AMEN1CYP3A4ALOX15MAPT | |
| SCHEMBL29072183 | 0.77 | KMT2A (0.62) | BTN3A1KMT2AMEN1CYP3A4ALOX15 | |
| SCHEMBL31354817 | 0.77 | KMT2A (0.62) | BTN3A1KMT2AMEN1CYP3A4ALOX15 | |
| SCHEMBL28247110 | 0.77 | KMT2A (0.36) | KMT2AMEN1CYP3A4ALOX15MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5231232-A | Method of preparing C-18 ketones used in the manufacture of Vitamins E and K | LOYOLA UNIVERSITY OF CHICAGO (US) | 1993-07-27 | — | — | US | disclosed |