Known targets — ChEMBL curated mechanism
PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Lysine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 10/20 | 0.45 |
| ▸ | LTA4H | P09960 | 3/20 | 0.40 |
| ▸ | GSR | P00390 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Lysine SCHEMBL7793333 | 1.00 | ITGB3 (0.45) | ITGB3ITGA2BLTA4HGSRALDH1A1 | |
| Lysine SCHEMBL7802101 | 0.87 | LTA4H (0.42) | ITGB3ITGA2BLTA4HGSR | |
| Lysine SCHEMBL7802098 | 0.87 | LTA4H (0.42) | ITGB3ITGA2BLTA4HGSR | |
| Lysine SCHEMBL7800214 | 0.85 | LTA4H (0.48) | ITGB3ITGA2BLTA4HGSRALDH1A1 | |
| Lysine SCHEMBL7800211 | 0.85 | LTA4H (0.48) | ITGB3ITGA2BLTA4HGSRALDH1A1 | |
| 2-(Aminomethyl)Phenol SCHEMBL7801569 | 0.84 | PPARA (0.42) | LTA4HALDH1A1LMNAMAPTHPGD | |
| Ornithine SCHEMBL7798813 | 0.82 | ITGB3 (0.51) | ITGB3ITGA2BGSRALDH1A1LMNA | |
| Lysine SCHEMBL7792811 | 0.82 | LTA4H (0.48) | ITGB3ITGA2BLTA4HALDH1A1LMNA | |
| Lysine SCHEMBL7792810 | 0.82 | LTA4H (0.48) | ITGB3ITGA2BLTA4HALDH1A1LMNA | |
| Ornithine SCHEMBL7792718 | 0.82 | LTA4H (0.48) | ITGB3ITGA2BLTA4HALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1076649-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 2001-02-21 | — | — | EP | disclosed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | disclosed |