Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1503147 | 0.92 | ALDH1A1 (0.39) | ALDH1A1MAPK1KMT2APPARGNR1H4 | |
| SCHEMBL22738226 | 0.90 | SCN9A (0.38) | ALDH1A1MAPK1KMT2ANR1H4MAOB | |
| SCHEMBL30193078 | 0.78 | KMT2A (0.40) | ALDH1A1MAPK1KMT2AMAOBPOLB | |
| SCHEMBL1503189 | 0.78 | KMT2A (0.40) | ALDH1A1MAPK1KMT2AMAOBPOLB | |
| SCHEMBL13577625 | 0.78 | KMT2A (0.48) | ALDH1A1MAPK1KMT2AMAOB | |
| SCHEMBL1503087 | 0.77 | EGLN1 (0.40) | ALDH1A1MAPK1KMT2APOLB | |
| SCHEMBL22719912 | 0.76 | KMT2A (0.39) | ALDH1A1MAPK1KMT2AMAOBPOLB | |
| SCHEMBL12935668 | 0.74 | KMT2A (0.42) | ALDH1A1MAPK1KMT2AMAOB | |
| SCHEMBL15746730 | 0.74 | PPARG (0.43) | MAPK1KMT2APPARGMAOBMAOA | |
| SCHEMBL22719950 | 0.74 | MAOB (0.39) | ALDH1A1MAPK1KMT2AMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009146555-A1 | HIV INTEGRASE INHIBITORS FROM PYRIDOXINE | AMBRILIA BIOPHARMA INC. (CA) | 2009-12-10 | — | — | WO | claimed |