Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | GSR | P00390 | 1/20 | 0.41 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.40 |
| ▸ | CPB2 | Q96IY4 | 6/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL195776 | 0.98 | ALDH1A1 (0.43) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1696964 | 0.95 | ALDH1A1 (0.46) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1696971 | 0.92 | ALDH1A1 (0.49) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL28490356 | 0.92 | ALDH1A1 (0.49) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1437767 | 0.87 | ALDH1A1 (0.50) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1696968 | 0.85 | GSR (0.44) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1696991 | 0.82 | ALDH1A1 (0.41) | ALDH1A1PKMGSRRNPEPCPB2 | |
| SCHEMBL1696978 | 0.82 | ALDH1A1 (0.40) | ALDH1A1PKMGSRRNPEPCPB2 | |
| Lysine SCHEMBL5606291 | 0.82 | GSR (0.48) | ALDH1A1PKMGSRCYP1A2CYP2C19 | |
| SCHEMBL12478991 | 0.76 | ALDH1A1 (0.43) | ALDH1A1PKMLMNACA12CA1 |
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-6730686-B1 | INCLUDING LOW DENSITY LIPOPROTEINS, TO TREAT OR PREVENT LIPID PEROXIDATION, AND TO TREAT OR PREVENT ATHEROSCLEROSIS | KANSAS UNIVERSITY MEDICAL CENTER | 2004-05-04 | — | — | US | disclosed |
| WO-2000022094-A2 | METHODS FOR INHIBITING OXIDATIVE MODIFICATION OF PROTEINS | KANSAS UNIVERSITY MEDICAL CENTER (US) | 2000-04-20 | — | — | WO | disclosed |