Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.96 |
| ▸ | HPGD | P15428 | 2/20 | 0.96 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.96 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.96 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.96 |
| ▸ | ABAT | P80404 | 1/20 | 0.96 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.96 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.70 |
| ▸ | XDH | P47989 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.66 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.65 |
| ▸ | TYR | P14679 | 2/20 | 0.62 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.62 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.62 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.62 |
| ▸ | STAT3 | P40763 | 2/20 | 0.62 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| Vanillin SCHEMBL720723 | 0.98 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL29354839 | 0.98 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL1213 | 0.98 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL19149274 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL20549709 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL8853913 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL19411839 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL19260053 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL11269339 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL4442606 | 0.96 | ALDH1A1 (0.96) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5596016-A | PROMOTERS OF MINERAL ABSORPTION, NUTRITIONAL BEVERAGES, BIOAVAILABILITY | ALBION INTERNATIONAL, INC. (US) | 1997-01-21 | — | — | US | disclosed |
| WO-1996006099-A1 | 1,2-DISUBSTITUTED AROMATIC CHELATES | ALBION INTERNATIONAL, INC. (US) | 1996-02-29 | — | — | WO | disclosed |