Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.65 |
| ▸ | TSHR | P16473 | 3/20 | 0.65 |
| ▸ | CA2 | P00918 | 5/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | FYN | P06241 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27859359 | 0.83 | ALDH1A1 (0.62) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| Ethylene SCHEMBL28844160 | 0.80 | ALDH1A1 (0.90) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL29613273 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL29358279 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL29440405 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL51803 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL9327128 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL410880 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL22729938 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1TSHRCA2ALOX15 | |
| SCHEMBL584830 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCA2ALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998043649-A2 | AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-10-08 | — | — | WO | disclosed |
| EP-0638075-A1 | THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-15 | — | — | EP | disclosed |
| WO-1994019335-A1 | THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-09-01 | — | — | WO | disclosed |