Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.34 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.32 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL18324924 | 0.92 | AKR1C3 (0.37) | PTGS2PTGS1AKR1C3AKR1C2AKR1B10 | |
| SCHEMBL20380566 | 0.91 | AKR1C3 (0.32) | AKR1C3AKR1C2 | |
| SCHEMBL18324919 | 0.89 | PTGS2 (0.34) | PTGS2PTGS1 | |
| SCHEMBL18324930 | 0.88 | PTGS2 (0.33) | PTGS2PTGS1 | |
| SCHEMBL20380706 | 0.87 | AKR1C3 (0.32) | PTGS2PTGS1AKR1C3AKR1C2AKR1B10 | |
| SCHEMBL20380622 | 0.87 | RPS6KA3 (0.35) | PTGS2PTGS1AKR1C3AKR1C2ALOX5AP | |
| SCHEMBL18324942 | 0.85 | AKR1C3 (0.37) | PTGS2PTGS1AKR1C3AKR1C2AKR1B10 | |
| SCHEMBL20380717 | 0.85 | ALOX5AP (0.36) | AKR1C3AKR1C2ALOX5APFEN1FFAR4 | |
| SCHEMBL18324935 | 0.85 | PTGS2 (0.34) | PTGS2PTGS1 | |
| SCHEMBL18855112 | 0.84 | AKR1C3 (0.34) | PTGS2PTGS1AKR1C3AKR1C2AKR1B10 |
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-20190284475-A1 | LIQUID CRYSTAL COMPOUND AND A LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME | DAXIN MATERIALS CORP. (TW) | 2019-09-19 | — | — | US | disclosed |