Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.44 |
| ▸ | SNCA | P37840 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 8/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.34 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.34 |
| ▸ | GMNN | O75496 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14566202 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1TRPV1 | |
| SCHEMBL29604975 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1TRPV1 | |
| SCHEMBL29435876 | 0.92 | ALDH1A1 (0.58) | ALDH1A1CYP3A4ALOX15TDP1TRPV1 | |
| SCHEMBL13580513 | 0.91 | ALDH1A1 (0.55) | ALDH1A1CYP3A4ALOX15TDP1TRPV1 | |
| SCHEMBL5532432 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL9856621 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL12494830 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL15609523 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL12494087 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL4285043 | 0.85 | ALDH1A1 (0.52) | ALDH1A1CYP3A4ALOX15TDP1TRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1442014-B1 | MANUFACTURE OF RETINOIDS | DSM IP ASSETS BV (NL) | 2007-03-21 | — | — | EP | disclosed |