Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.34 |
| ▸ | UNG | P13051 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.32 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.32 |
| ▸ | ABAT | P80404 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29955805 | 0.75 | PTGS2 (0.38) | PTGS2ALDH1A1TDP1HSD17B10PTGES | |
| SCHEMBL2232812 | 0.70 | ALDH1A1 (0.50) | PTGS2ALDH1A1TDP1HSD17B10KDM4E | |
| SCHEMBL22835286 | 0.69 | AKR1B1 (0.43) | PTGS2ALDH1A1HSD17B10AKR1B1POLB | |
| Potassium Ion SCHEMBL26696519 | 0.69 | PTGS2 (0.37) | PTGS2ALDH1A1TDP1HSD17B10KDM4E | |
| SCHEMBL16693173 | 0.66 | ALDH1A1 (0.42) | PTGS2ALDH1A1TDP1HSD17B10PTGES | |
| SCHEMBL1853930 | 0.66 | ALDH1A1 (0.42) | PTGS2ALDH1A1TDP1HSD17B10PTGES | |
| SCHEMBL16693107 | 0.66 | ALDH1A1 (0.42) | PTGS2ALDH1A1TDP1HSD17B10PTGES | |
| SCHEMBL11365378 | 0.66 | AKR1B1 (0.40) | PTGS2HSD17B10AKR1B1 | |
| SCHEMBL5151589 | 0.66 | ALDH1A1 (0.42) | PTGS2ALDH1A1TDP1HSD17B10KDM4E | |
| SCHEMBL13614283 | 0.65 | ALDH1A1 (0.49) | PTGS2ALDH1A1TDP1HSD17B10KDM4E |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |