Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL8731685 | 0.77 | CYP3A4 (0.43) | ABCB1 | |
| SCHEMBL3630532 | 0.77 | CYP3A4 (0.43) | ABCB1 | |
| SCHEMBL3150036 | 0.77 | CYP3A4 (0.43) | ABCB1 | |
| SCHEMBL11845051 | 0.71 | — | — | |
| SCHEMBL2184267 | 0.69 | NFE2L2 (0.36) | — | |
| SCHEMBL8442444 | 0.67 | — | — | |
| SCHEMBL14458084 | 0.65 | — | — | |
| SCHEMBL811287 | 0.62 | NPC1 (0.33) | — | |
| SCHEMBL3208597 | 0.62 | — | — | |
| SCHEMBL6192821 | 0.62 | — | — |
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-7247752-B2 | Stereoselectively reducing 2,6,6-trimethyl-2-cyclohexene-1,4-dione with an optically active chiral catalyst to form an optically active hydroxycyclohexenone, contacting the product with a reducing agent to form an optically active diol, and using the diol to form astaxanthin | CARDAX PHARMACEUTICALS, INC. (US) | 2007-07-24 | — | — | US | disclosed |