Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL21020289 | 0.86 | ALDH1A1 (0.37) | ALDH1A1NPC1POLBHPGDRAB9A | |
| SCHEMBL20649758 | 0.86 | KDM4E (0.35) | ALDH1A1SMN1; SMN2KDM4EGAAMAPT | |
| SCHEMBL20649760 | 0.86 | — | — | |
| SCHEMBL20650765 | 0.85 | KDM4E (0.33) | ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL23967896 | 0.83 | CYP1A2 (0.36) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL20650764 | 0.83 | KDM4E (0.33) | ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL20649762 | 0.83 | KDM4E (0.33) | ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL20650160 | 0.82 | TNKS (0.35) | — | |
| SCHEMBL20650780 | 0.82 | MCL1 (0.33) | — | |
| SCHEMBL20649840 | 0.81 | ALDH1A1 (0.34) | ALDH1A1HPGDKDM4EGAAMAPT |
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-3428152-B1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2021-11-03 | — | — | EP | disclosed |