Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | PPARD | Q03181 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6015468 | 0.83 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2ALOX15HSD17B10MAPT | |
| SCHEMBL17748388 | 0.83 | HSD17B10 (0.35) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| SCHEMBL28307309 | 0.81 | CYP1A2 (0.53) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| SCHEMBL5831132 | 0.78 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| SCHEMBL8397324 | 0.78 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2CYP3A4TP53TSHR | |
| Hydrogen Peroxide SCHEMBL5496256 | 0.78 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| Hydrogen Peroxide SCHEMBL7816450 | 0.78 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| SCHEMBL173301 | 0.78 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 | |
| SCHEMBL23230257 | 0.77 | LMNA (0.43) | ALDH1A1TSHRCYP1A2CYP2D6HSD17B10 | |
| SCHEMBL22059731 | 0.76 | GABRA1 (0.39) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 |
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-0283326-B1 | LIQUID CRYSTAL COMPOUNDS WITH 4-(OPTICALLY ACTIVE ALKYL)-3-CYANOPHENYL GROUPS | Chisso Corporation (JP) | 1992-06-24 | — | — | EP | disclosed |
| US-4913838-A | LARGE SPONTANEOUS POLARIZATION VALUE | CHISSO CORPORATION (JP) | 1990-04-03 | — | — | US | disclosed |