Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21868082 | 0.89 | ESR1 (0.31) | — | |
| SCHEMBL21868282 | 0.87 | PDK2 (0.33) | ALDH1A1HPGDSMN1; SMN2HDAC8 | |
| SCHEMBL21867584 | 0.85 | ALDH1A1 (0.32) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL20619245 | 0.84 | ALDH1A1 (0.32) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL21868720 | 0.82 | PDK2 (0.38) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL20619072 | 0.82 | ALDH1A1 (0.32) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL21867857 | 0.81 | ALDH1A1 (0.30) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL21868101 | 0.78 | PDK2 (0.40) | — | |
| SCHEMBL24293855 | 0.78 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL24905104 | 0.77 | PDK2 (0.41) | — |
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-2020067823-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | 주식회사 엘지화학 | 2020-04-02 | — | — | WO | disclosed |