Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29472390 | 0.83 | ALDH1A1 (0.64) | ALDH1A1KMT2AALDH1A3HSD17B10KDM4E | |
| SCHEMBL42757 | 0.83 | ALDH1A1 (0.64) | ALDH1A1KMT2AALDH1A3HSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL30783012 | 0.81 | ALDH1A1 (0.61) | ALDH1A1POLBPKMMAPK1KMT2A | |
| SCHEMBL6349916 | 0.78 | KDM4E (0.42) | ALDH1A1KDM4EENPP2FDPS | |
| SCHEMBL2360504 | 0.78 | TRPA1 (0.38) | ALDH1A1POLBPKMMAPK1KMT2A | |
| SCHEMBL2360503 | 0.78 | TRPA1 (0.38) | ALDH1A1POLBPKMMAPK1KMT2A | |
| SCHEMBL6349913 | 0.78 | KDM4E (0.42) | ALDH1A1KDM4EENPP2FDPS | |
| SCHEMBL2779298 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KMT2AKDM4EENPP2FDPS | |
| SCHEMBL10734385 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KMT2AKDM4EENPP2FDPS | |
| SCHEMBL15282103 | 0.76 | NFE2L2 (0.52) | KDM4EENPP2FDPSTRPA1RAB9A |
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-7462620-B2 | Pyrimidinone derivatives and their use in the treatment of atherosclerosis | SMITHKLINE BEECHAM, PLC (GB) | 2008-12-09 | — | — | US | disclosed |