Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 15/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28792537 | 0.81 | ERN1 (0.57) | ERN1 | |
| SCHEMBL29672067 | 0.81 | ERN1 (0.57) | ERN1 | |
| SCHEMBL29672080 | 0.80 | ERN1 (0.64) | ERN1 | |
| SCHEMBL29672059 | 0.78 | AKR1C3 (0.49) | ERN1 | |
| SCHEMBL29672068 | 0.77 | ERN1 (0.53) | ERN1 | |
| SCHEMBL6505690 | 0.77 | ERN1 (0.72) | ERN1 | |
| SCHEMBL6536018 | 0.76 | CHEK1 (0.45) | ERN1CHEK1 | |
| SCHEMBL17239835 | 0.76 | CHEK1 (0.51) | CHEK1ACLY | |
| SCHEMBL4600487 | 0.75 | ERN1 (0.43) | ERN1ACLY | |
| SCHEMBL4599474 | 0.74 | ERN1 (0.42) | ERN1ACLY |
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 |
|---|---|---|---|---|---|---|---|
| CN-112961041-B | Catechol compound and preparation method and application thereof | 心远(广州)药物研究有限公司 | 2022-06-21 | — | — | CN | disclosed |