Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | ESR1 | P03372 | 4/20 | 0.55 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.55 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.51 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13610198 | 1.00 | ALDH1A1 (0.59) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL15702300 | 1.00 | ALDH1A1 (0.59) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL9499078 | 0.98 | ALDH1A1 (0.56) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL9494666 | 0.94 | ESR1 (0.58) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL9497679 | 0.87 | LMNA (0.58) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL28456871 | 0.84 | TDP1 (0.46) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL18668815 | 0.84 | TDP1 (0.49) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL1183367 | 0.83 | CES2 (0.56) | ALDH1A1NPC1RAB9ALMNATSHR | |
| SCHEMBL19747391 | 0.81 | PRSS1 (0.54) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL10591672 | 0.81 | ALDH1A1 (0.83) | ALDH1A1NPC1MAPTRAB9ALMNA |
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-5331056-A | Electroconductive polymer compositions produced from polymerizable amphiphilic heterocycles | RHONE-POULENC FILMS (FR) | 1994-07-19 | — | — | US | disclosed |